שינויים
ב־31 בינואר 2023 בשעה 17:03:09 +1000,
-
הכותרת הוחלפה לכדי Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm (לשעבר as_solution_processed_6wtpercent_cbp_irppy2acac_with-choloroform_310k)
-
התיאור של Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm עודכן לכדי
A simulation of a 5wt% Ir(ppy)2(acac):CBP organic thinfilm that is being formed by solvent evaporation. The solvent used is chloroform. All 11 files are from different stages of the evaporation from the start of the simulation to the dried film.
-
התגיות הבאות נוספו אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_energy_00002.edr נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_topology_00008.top נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_restraints_00009.gro נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_topology_00001.top נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_energy_00001.edr נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_log_00004.log נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_final-coordinates_00005.gro נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_control_00002.mdp נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_tpr_00008.tpr נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_topology_00011.top נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב IPAS_oldcharges_heavyH.itp נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_control_00006.mdp נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_tpr_00002.tpr נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_control_00007.mdp נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_energy_00009.edr נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_energy_00010.edr נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_log_00010.log נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_log_00002.log נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_control_00005.mdp נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_final-coordinates_00006.gro נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_energy_00007.edr נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_restraints_00005.gro נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_tpr_00004.tpr נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_final-coordinates_00004.gro נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_final-coordinates_00009.gro נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_topology_00002.top נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_restraints_00008.gro נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_tpr_00001.tpr נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_final-coordinates_00003.gro נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_control_00009.mdp נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_log_00011.log נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_input-coordinates_00007.gro נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_energy_00008.edr נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_tpr_00005.tpr נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_energy_00004.edr נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_input-coordinates_00006.gro נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב CBP_heavyH.itp נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_control_00001.mdp נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_control_00008.mdp נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב GRM4x_restr_massive.itp נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_control_00004.mdp נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_control_00003.mdp נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_input-coordinates_00002.gro נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב IPAR_oldcharges_heavyH.itp נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_topology_00010.top נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_log_00003.log נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_tpr_00011.tpr נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_input-coordinates_00005.gro נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_input-coordinates_00010.gro נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_restraints_00010.gro נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_restraints_00004.gro נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב GRM4x_restr_nobonds_2layers.itp נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_tpr_00003.tpr נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_energy_00003.edr נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_log_00009.log נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_tpr_00007.tpr נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_log_00001.log נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_tpr_00010.tpr נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_input-coordinates_00011.gro נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_energy_00011.edr נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_final-coordinates_00002.gro נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_tpr_00006.tpr נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב forcefield.itp נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_final-coordinates_00010.gro נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_topology_00005.top נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_restraints_00006.gro נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_restraints_00001.gro נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_topology_00004.top נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_final-coordinates_00001.gro נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_tpr_00009.tpr נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_log_00008.log נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_input-coordinates_00004.gro נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_control_00010.mdp נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_input-coordinates_00003.gro נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_control_00011.mdp נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_input-coordinates_00009.gro נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב rigid_chcl3.itp נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_restraints_00003.gro נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_topology_00006.top נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_log_00007.log נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_energy_00006.edr נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_final-coordinates_00011.gro נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_final-coordinates_00008.gro נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_final-coordinates_00007.gro נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_input-coordinates_00001.gro נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_topology_00009.top נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_topology_00007.top נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_energy_00005.edr נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_restraints_00011.gro נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_log_00006.log נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_restraints_00002.gro נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_restraints_00007.gro נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_log_00005.log נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_input-coordinates_00008.gro נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
-
המשאב solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_topology_00003.top נוסף אל Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
f | 1 | { | f | 1 | { |
2 | "author": null, | 2 | "author": null, | ||
3 | "author_email": null, | 3 | "author_email": null, | ||
4 | "creator_user_id": "26e9b37a-a639-46f2-9a41-f9295eef2db8", | 4 | "creator_user_id": "26e9b37a-a639-46f2-9a41-f9295eef2db8", | ||
5 | "extras": [], | 5 | "extras": [], | ||
6 | "groups": [], | 6 | "groups": [], | ||
7 | "id": "baee1840-1440-469f-8e50-a78795749524", | 7 | "id": "baee1840-1440-469f-8e50-a78795749524", | ||
8 | "isopen": false, | 8 | "isopen": false, | ||
9 | "license_id": null, | 9 | "license_id": null, | ||
10 | "license_title": null, | 10 | "license_title": null, | ||
11 | "maintainer": null, | 11 | "maintainer": null, | ||
12 | "maintainer_email": null, | 12 | "maintainer_email": null, | ||
13 | "metadata_created": "2023-01-31T07:03:08.547657", | 13 | "metadata_created": "2023-01-31T07:03:08.547657", | ||
n | 14 | "metadata_modified": "2023-01-31T07:03:08.547662", | n | 14 | "metadata_modified": "2023-01-31T07:03:09.220093", |
15 | "name": | 15 | "name": | ||
16 | s_solution_processed_6wtpercent_cbp_irppy2acac_with-choloroform_310k", | 16 | s_solution_processed_6wtpercent_cbp_irppy2acac_with-choloroform_310k", | ||
n | 17 | "notes": null, | n | 17 | "notes": "A simulation of a 5wt% Ir(ppy)2(acac):CBP organic thinfilm |
18 | that is being formed by solvent evaporation. The solvent used is | ||||
19 | chloroform. All 11 files are from different stages of the evaporation | ||||
20 | from the start of the simulation to the dried film.", | ||||
18 | "num_resources": 0, | 21 | "num_resources": 95, | ||
19 | "num_tags": 0, | 22 | "num_tags": 11, | ||
20 | "organization": { | 23 | "organization": { | ||
21 | "approval_status": "approved", | 24 | "approval_status": "approved", | ||
22 | "created": "2018-08-22T23:34:31.662568", | 25 | "created": "2018-08-22T23:34:31.662568", | ||
23 | "description": "The group focuses on understanding and predicting | 26 | "description": "The group focuses on understanding and predicting | ||
24 | the macroscopic (experimentally observable) properties of biomolecular | 27 | the macroscopic (experimentally observable) properties of biomolecular | ||
25 | systems such as proteins, nucleic acids and lipid aggregates, in terms | 28 | systems such as proteins, nucleic acids and lipid aggregates, in terms | ||
26 | of the interactions between atoms. In particular, our work | 29 | of the interactions between atoms. In particular, our work | ||
27 | concentrates on the development of tools (i.e. simulation software, | 30 | concentrates on the development of tools (i.e. simulation software, | ||
28 | atomic force fields, theoretical models and experimental techniques) | 31 | atomic force fields, theoretical models and experimental techniques) | ||
29 | that can be used to understand and predict the physico-chemical basis | 32 | that can be used to understand and predict the physico-chemical basis | ||
30 | of interactions and dynamic processes within biomolecular systems. | 33 | of interactions and dynamic processes within biomolecular systems. | ||
31 | Specific areas of interest include structure prediction, protein and | 34 | Specific areas of interest include structure prediction, protein and | ||
32 | peptide folding, the self-assembly of protein/lipid complexes and the | 35 | peptide folding, the self-assembly of protein/lipid complexes and the | ||
33 | calculation of thermodynamic properties such as ligand binding | 36 | calculation of thermodynamic properties such as ligand binding | ||
34 | affinities.\r\n\r\n(Image created by Dr D. Poger)", | 37 | affinities.\r\n\r\n(Image created by Dr D. Poger)", | ||
35 | "id": "13d88f1a-558b-460e-ad12-400abee89835", | 38 | "id": "13d88f1a-558b-460e-ad12-400abee89835", | ||
36 | "image_url": "2022-01-21-061851.980724mdgrouptoys.jpg", | 39 | "image_url": "2022-01-21-061851.980724mdgrouptoys.jpg", | ||
37 | "is_organization": true, | 40 | "is_organization": true, | ||
38 | "name": "mduq", | 41 | "name": "mduq", | ||
39 | "state": "active", | 42 | "state": "active", | ||
40 | "title": "Molecular Dynamics Group UQ", | 43 | "title": "Molecular Dynamics Group UQ", | ||
41 | "type": "organization" | 44 | "type": "organization" | ||
42 | }, | 45 | }, | ||
43 | "owner_org": "13d88f1a-558b-460e-ad12-400abee89835", | 46 | "owner_org": "13d88f1a-558b-460e-ad12-400abee89835", | ||
44 | "private": false, | 47 | "private": false, | ||
45 | "relationships_as_object": [], | 48 | "relationships_as_object": [], | ||
46 | "relationships_as_subject": [], | 49 | "relationships_as_subject": [], | ||
n | 47 | "resources": [], | n | 50 | "resources": [ |
51 | { | ||||
52 | "cache_last_updated": null, | ||||
53 | "cache_url": null, | ||||
54 | "created": "2023-01-31T07:03:09.269867", | ||||
55 | "description": null, | ||||
56 | "format": "mdp", | ||||
57 | "hash": "", | ||||
58 | "id": "56f5cd82-4d61-46ef-bc79-7b9e66f7c87d", | ||||
59 | "last_modified": null, | ||||
60 | "metadata_modified": "2023-01-31T07:03:09.223414", | ||||
61 | "mimetype": null, | ||||
62 | "mimetype_inner": null, | ||||
63 | "name": | ||||
64 | ed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_control_00001.mdp", | ||||
65 | "owner_org": "mduq", | ||||
66 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
67 | "position": 0, | ||||
68 | "resource_type": "control", | ||||
69 | "run": 1, | ||||
70 | "size": 1795, | ||||
71 | "state": "active", | ||||
72 | "url": | ||||
73 | ed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_control_00001.mdp", | ||||
74 | "url_type": null | ||||
75 | }, | ||||
76 | { | ||||
77 | "cache_last_updated": null, | ||||
78 | "cache_url": null, | ||||
79 | "created": "2023-01-31T07:03:09.269870", | ||||
80 | "description": null, | ||||
81 | "format": "itp", | ||||
82 | "hash": "", | ||||
83 | "id": "736e1af8-6008-4c60-9b60-75a4f92b37f1", | ||||
84 | "last_modified": null, | ||||
85 | "metadata_modified": "2023-01-31T07:03:09.223555", | ||||
86 | "mimetype": null, | ||||
87 | "mimetype_inner": null, | ||||
88 | "name": "GRM4x_restr_nobonds_2layers.itp", | ||||
89 | "owner_org": "mduq", | ||||
90 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
91 | "position": 1, | ||||
92 | "resource_type": "forcefield-files", | ||||
93 | "run": 1, | ||||
94 | "size": 7205042, | ||||
95 | "state": "active", | ||||
96 | "url": | ||||
97 | qOUyN-xNhvoG12hUjBt8VbA10mFn5BWruZRM/GRM4x_restr_nobonds_2layers.itp", | ||||
98 | "url_type": null | ||||
99 | }, | ||||
100 | { | ||||
101 | "cache_last_updated": null, | ||||
102 | "cache_url": null, | ||||
103 | "created": "2023-01-31T07:03:09.269872", | ||||
104 | "description": null, | ||||
105 | "format": "itp", | ||||
106 | "hash": "", | ||||
107 | "id": "4bfca55c-5975-451d-9e14-169b204f668b", | ||||
108 | "last_modified": null, | ||||
109 | "metadata_modified": "2023-01-31T07:03:09.223673", | ||||
110 | "mimetype": null, | ||||
111 | "mimetype_inner": null, | ||||
112 | "name": "IPAR_oldcharges_heavyH.itp", | ||||
113 | "owner_org": "mduq", | ||||
114 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
115 | "position": 2, | ||||
116 | "resource_type": "forcefield-files", | ||||
117 | "run": 1, | ||||
118 | "size": 18247, | ||||
119 | "state": "active", | ||||
120 | "url": | ||||
121 | 40IcK_c7q0rAr-BZHyKU0zcwqYv4uUZKen3-rreiI/IPAR_oldcharges_heavyH.itp", | ||||
122 | "url_type": null | ||||
123 | }, | ||||
124 | { | ||||
125 | "cache_last_updated": null, | ||||
126 | "cache_url": null, | ||||
127 | "created": "2023-01-31T07:03:09.269873", | ||||
128 | "description": null, | ||||
129 | "format": "itp", | ||||
130 | "hash": "", | ||||
131 | "id": "d9ed0f69-ae3d-4511-8d10-70553c033d2a", | ||||
132 | "last_modified": null, | ||||
133 | "metadata_modified": "2023-01-31T07:03:09.223787", | ||||
134 | "mimetype": null, | ||||
135 | "mimetype_inner": null, | ||||
136 | "name": "CBP_heavyH.itp", | ||||
137 | "owner_org": "mduq", | ||||
138 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
139 | "position": 3, | ||||
140 | "resource_type": "forcefield-files", | ||||
141 | "run": 1, | ||||
142 | "size": 22450, | ||||
143 | "state": "active", | ||||
144 | "url": | ||||
145 | eld-files/yHg3hZ1a74O42UGwXKNxx_YVWAsKKEv8dNmEjDOjmyg/CBP_heavyH.itp", | ||||
146 | "url_type": null | ||||
147 | }, | ||||
148 | { | ||||
149 | "cache_last_updated": null, | ||||
150 | "cache_url": null, | ||||
151 | "created": "2023-01-31T07:03:09.269874", | ||||
152 | "description": null, | ||||
153 | "format": "itp", | ||||
154 | "hash": "", | ||||
155 | "id": "7501df77-617c-4f3c-bbeb-0a2c9dc11308", | ||||
156 | "last_modified": null, | ||||
157 | "metadata_modified": "2023-01-31T07:03:09.223898", | ||||
158 | "mimetype": null, | ||||
159 | "mimetype_inner": null, | ||||
160 | "name": "forcefield.itp", | ||||
161 | "owner_org": "mduq", | ||||
162 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
163 | "position": 4, | ||||
164 | "resource_type": "forcefield-files", | ||||
165 | "run": 1, | ||||
166 | "size": 176, | ||||
167 | "state": "active", | ||||
168 | "url": | ||||
169 | eld-files/vA2D2yxF9JKRl9XKH67ltSOKVmLNk3-bg-GtXlhdjLc/forcefield.itp", | ||||
170 | "url_type": null | ||||
171 | }, | ||||
172 | { | ||||
173 | "cache_last_updated": null, | ||||
174 | "cache_url": null, | ||||
175 | "created": "2023-01-31T07:03:09.269876", | ||||
176 | "description": null, | ||||
177 | "format": "itp", | ||||
178 | "hash": "", | ||||
179 | "id": "421b27db-77a9-499c-a5ce-41c40c3998d2", | ||||
180 | "last_modified": null, | ||||
181 | "metadata_modified": "2023-01-31T07:03:09.224008", | ||||
182 | "mimetype": null, | ||||
183 | "mimetype_inner": null, | ||||
184 | "name": "IPAS_oldcharges_heavyH.itp", | ||||
185 | "owner_org": "mduq", | ||||
186 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
187 | "position": 5, | ||||
188 | "resource_type": "forcefield-files", | ||||
189 | "run": 1, | ||||
190 | "size": 18247, | ||||
191 | "state": "active", | ||||
192 | "url": | ||||
193 | cgwpMLE0oXu0tECyCE9eqMQSYpO5LRSajEnxMyVG0/IPAS_oldcharges_heavyH.itp", | ||||
194 | "url_type": null | ||||
195 | }, | ||||
196 | { | ||||
197 | "cache_last_updated": null, | ||||
198 | "cache_url": null, | ||||
199 | "created": "2023-01-31T07:03:09.269877", | ||||
200 | "description": null, | ||||
201 | "format": "itp", | ||||
202 | "hash": "", | ||||
203 | "id": "03dc2564-c090-4435-b958-6b8ac4e7ea39", | ||||
204 | "last_modified": null, | ||||
205 | "metadata_modified": "2023-01-31T07:03:09.224117", | ||||
206 | "mimetype": null, | ||||
207 | "mimetype_inner": null, | ||||
208 | "name": "GRM4x_restr_massive.itp", | ||||
209 | "owner_org": "mduq", | ||||
210 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
211 | "position": 6, | ||||
212 | "resource_type": "forcefield-files", | ||||
213 | "run": 1, | ||||
214 | "size": 2145889, | ||||
215 | "state": "active", | ||||
216 | "url": | ||||
217 | /koSr1Q0HkC7WzdvhsjY0xuYpszJPB8lk_dAvT1exmrU/GRM4x_restr_massive.itp", | ||||
218 | "url_type": null | ||||
219 | }, | ||||
220 | { | ||||
221 | "cache_last_updated": null, | ||||
222 | "cache_url": null, | ||||
223 | "created": "2023-01-31T07:03:09.269878", | ||||
224 | "description": null, | ||||
225 | "format": "itp", | ||||
226 | "hash": "", | ||||
227 | "id": "992dea6e-64b6-4826-b272-27ec509caaae", | ||||
228 | "last_modified": null, | ||||
229 | "metadata_modified": "2023-01-31T07:03:09.224226", | ||||
230 | "mimetype": null, | ||||
231 | "mimetype_inner": null, | ||||
232 | "name": "rigid_chcl3.itp", | ||||
233 | "owner_org": "mduq", | ||||
234 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
235 | "position": 7, | ||||
236 | "resource_type": "forcefield-files", | ||||
237 | "run": 1, | ||||
238 | "size": 5309, | ||||
239 | "state": "active", | ||||
240 | "url": | ||||
241 | ld-files/n9KV8JWxtI9NFjIuFBG_mi8m0V2Ih9b_vpFfF_yRLPA/rigid_chcl3.itp", | ||||
242 | "url_type": null | ||||
243 | }, | ||||
244 | { | ||||
245 | "cache_last_updated": null, | ||||
246 | "cache_url": null, | ||||
247 | "created": "2023-01-31T07:03:09.269879", | ||||
248 | "description": null, | ||||
249 | "format": "gro", | ||||
250 | "hash": "", | ||||
251 | "id": "69577300-f8a8-4fe4-8806-6a41d50f4eab", | ||||
252 | "last_modified": null, | ||||
253 | "metadata_modified": "2023-01-31T07:03:09.224335", | ||||
254 | "mimetype": null, | ||||
255 | "mimetype_inner": null, | ||||
256 | "name": | ||||
257 | ent_CBP_Irppy2acac_with-choloroform_310K_input-coordinates_00001.gro", | ||||
258 | "owner_org": "mduq", | ||||
259 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
260 | "position": 8, | ||||
261 | "resource_type": "input-coordinates", | ||||
262 | "run": 1, | ||||
263 | "size": 125001289, | ||||
264 | "state": "active", | ||||
265 | "url": | ||||
266 | ent_CBP_Irppy2acac_with-choloroform_310K_input-coordinates_00001.gro", | ||||
267 | "url_type": null | ||||
268 | }, | ||||
269 | { | ||||
270 | "cache_last_updated": null, | ||||
271 | "cache_url": null, | ||||
272 | "created": "2023-01-31T07:03:09.269881", | ||||
273 | "description": null, | ||||
274 | "format": "log", | ||||
275 | "hash": "", | ||||
276 | "id": "49c18224-b174-48db-873f-80948b7457db", | ||||
277 | "last_modified": null, | ||||
278 | "metadata_modified": "2023-01-31T07:03:09.224444", | ||||
279 | "mimetype": null, | ||||
280 | "mimetype_inner": null, | ||||
281 | "name": | ||||
282 | cessed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_log_00001.log", | ||||
283 | "owner_org": "mduq", | ||||
284 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
285 | "position": 9, | ||||
286 | "resource_type": "log", | ||||
287 | "run": 1, | ||||
288 | "size": 32709, | ||||
289 | "state": "active", | ||||
290 | "url": | ||||
291 | cessed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_log_00001.log", | ||||
292 | "url_type": null | ||||
293 | }, | ||||
294 | { | ||||
295 | "cache_last_updated": null, | ||||
296 | "cache_url": null, | ||||
297 | "created": "2023-01-31T07:03:09.269882", | ||||
298 | "description": null, | ||||
299 | "format": "edr", | ||||
300 | "hash": "", | ||||
301 | "id": "b9bb69d5-c507-47f0-9aa2-da63cb7aba38", | ||||
302 | "last_modified": null, | ||||
303 | "metadata_modified": "2023-01-31T07:03:09.224551", | ||||
304 | "mimetype": null, | ||||
305 | "mimetype_inner": null, | ||||
306 | "name": | ||||
307 | sed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_energy_00001.edr", | ||||
308 | "owner_org": "mduq", | ||||
309 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
310 | "position": 10, | ||||
311 | "resource_type": "energy", | ||||
312 | "run": 1, | ||||
313 | "size": 7280, | ||||
314 | "state": "active", | ||||
315 | "url": | ||||
316 | sed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_energy_00001.edr", | ||||
317 | "url_type": null | ||||
318 | }, | ||||
319 | { | ||||
320 | "cache_last_updated": null, | ||||
321 | "cache_url": null, | ||||
322 | "created": "2023-01-31T07:03:09.269883", | ||||
323 | "description": null, | ||||
324 | "format": "tpr", | ||||
325 | "hash": "", | ||||
326 | "id": "439364ff-3d14-4239-9e47-59c92c452cc9", | ||||
327 | "last_modified": null, | ||||
328 | "metadata_modified": "2023-01-31T07:03:09.224660", | ||||
329 | "mimetype": null, | ||||
330 | "mimetype_inner": null, | ||||
331 | "name": | ||||
332 | cessed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_tpr_00001.tpr", | ||||
333 | "owner_org": "mduq", | ||||
334 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
335 | "position": 11, | ||||
336 | "resource_type": "tpr", | ||||
337 | "run": 1, | ||||
338 | "size": 60563724, | ||||
339 | "state": "active", | ||||
340 | "url": | ||||
341 | cessed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_tpr_00001.tpr", | ||||
342 | "url_type": null | ||||
343 | }, | ||||
344 | { | ||||
345 | "cache_last_updated": null, | ||||
346 | "cache_url": null, | ||||
347 | "created": "2023-01-31T07:03:09.269884", | ||||
348 | "description": null, | ||||
349 | "format": "top", | ||||
350 | "hash": "", | ||||
351 | "id": "b2749d1b-32f5-4c1d-b25b-5b2aa2d4b26b", | ||||
352 | "last_modified": null, | ||||
353 | "metadata_modified": "2023-01-31T07:03:09.224769", | ||||
354 | "mimetype": null, | ||||
355 | "mimetype_inner": null, | ||||
356 | "name": | ||||
357 | d_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_topology_00001.top", | ||||
358 | "owner_org": "mduq", | ||||
359 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
360 | "position": 12, | ||||
361 | "resource_type": "topology", | ||||
362 | "run": 1, | ||||
363 | "size": 3438, | ||||
364 | "state": "active", | ||||
365 | "url": | ||||
366 | d_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_topology_00001.top", | ||||
367 | "url_type": null | ||||
368 | }, | ||||
369 | { | ||||
370 | "cache_last_updated": null, | ||||
371 | "cache_url": null, | ||||
372 | "created": "2023-01-31T07:03:09.269886", | ||||
373 | "description": null, | ||||
374 | "format": "gro", | ||||
375 | "hash": "", | ||||
376 | "id": "c4b9c18e-1be2-4245-bcef-2f1cb425767b", | ||||
377 | "last_modified": null, | ||||
378 | "metadata_modified": "2023-01-31T07:03:09.224877", | ||||
379 | "mimetype": null, | ||||
380 | "mimetype_inner": null, | ||||
381 | "name": | ||||
382 | ent_CBP_Irppy2acac_with-choloroform_310K_final-coordinates_00001.gro", | ||||
383 | "owner_org": "mduq", | ||||
384 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
385 | "position": 13, | ||||
386 | "resource_type": "final-coordinates", | ||||
387 | "run": 1, | ||||
388 | "size": 125001274, | ||||
389 | "state": "active", | ||||
390 | "url": | ||||
391 | ent_CBP_Irppy2acac_with-choloroform_310K_final-coordinates_00001.gro", | ||||
392 | "url_type": null | ||||
393 | }, | ||||
394 | { | ||||
395 | "cache_last_updated": null, | ||||
396 | "cache_url": null, | ||||
397 | "created": "2023-01-31T07:03:09.269887", | ||||
398 | "description": null, | ||||
399 | "format": "gro", | ||||
400 | "hash": "", | ||||
401 | "id": "d49a3381-7d4f-451a-92b6-d41862248f2d", | ||||
402 | "last_modified": null, | ||||
403 | "metadata_modified": "2023-01-31T07:03:09.224985", | ||||
404 | "mimetype": null, | ||||
405 | "mimetype_inner": null, | ||||
406 | "name": | ||||
407 | 6wtpercent_CBP_Irppy2acac_with-choloroform_310K_restraints_00001.gro", | ||||
408 | "owner_org": "mduq", | ||||
409 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
410 | "position": 14, | ||||
411 | "resource_type": "restraints", | ||||
412 | "run": 1, | ||||
413 | "size": 125001289, | ||||
414 | "state": "active", | ||||
415 | "url": | ||||
416 | 6wtpercent_CBP_Irppy2acac_with-choloroform_310K_restraints_00001.gro", | ||||
417 | "url_type": null | ||||
418 | }, | ||||
419 | { | ||||
420 | "cache_last_updated": null, | ||||
421 | "cache_url": null, | ||||
422 | "created": "2023-01-31T07:03:09.269888", | ||||
423 | "description": null, | ||||
424 | "format": "mdp", | ||||
425 | "hash": "", | ||||
426 | "id": "cb3f224f-05b7-4e54-8af5-69903df50c94", | ||||
427 | "last_modified": null, | ||||
428 | "metadata_modified": "2023-01-31T07:03:09.225093", | ||||
429 | "mimetype": null, | ||||
430 | "mimetype_inner": null, | ||||
431 | "name": | ||||
432 | ed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_control_00002.mdp", | ||||
433 | "owner_org": "mduq", | ||||
434 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
435 | "position": 15, | ||||
436 | "resource_type": "control", | ||||
437 | "run": 2, | ||||
438 | "size": 1728, | ||||
439 | "state": "active", | ||||
440 | "url": | ||||
441 | ed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_control_00002.mdp", | ||||
442 | "url_type": null | ||||
443 | }, | ||||
444 | { | ||||
445 | "cache_last_updated": null, | ||||
446 | "cache_url": null, | ||||
447 | "created": "2023-01-31T07:03:09.269890", | ||||
448 | "description": null, | ||||
449 | "format": "gro", | ||||
450 | "hash": "", | ||||
451 | "id": "016882de-b848-44f4-ba06-5c4eb9ed38be", | ||||
452 | "last_modified": null, | ||||
453 | "metadata_modified": "2023-01-31T07:03:09.225201", | ||||
454 | "mimetype": null, | ||||
455 | "mimetype_inner": null, | ||||
456 | "name": | ||||
457 | ent_CBP_Irppy2acac_with-choloroform_310K_input-coordinates_00002.gro", | ||||
458 | "owner_org": "mduq", | ||||
459 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
460 | "position": 16, | ||||
461 | "resource_type": "input-coordinates", | ||||
462 | "run": 2, | ||||
463 | "size": 68494431, | ||||
464 | "state": "active", | ||||
465 | "url": | ||||
466 | ent_CBP_Irppy2acac_with-choloroform_310K_input-coordinates_00002.gro", | ||||
467 | "url_type": null | ||||
468 | }, | ||||
469 | { | ||||
470 | "cache_last_updated": null, | ||||
471 | "cache_url": null, | ||||
472 | "created": "2023-01-31T07:03:09.269891", | ||||
473 | "description": null, | ||||
474 | "format": "log", | ||||
475 | "hash": "", | ||||
476 | "id": "a41bb7b0-6ff8-4889-a807-2f6805c87741", | ||||
477 | "last_modified": null, | ||||
478 | "metadata_modified": "2023-01-31T07:03:09.225322", | ||||
479 | "mimetype": null, | ||||
480 | "mimetype_inner": null, | ||||
481 | "name": | ||||
482 | cessed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_log_00002.log", | ||||
483 | "owner_org": "mduq", | ||||
484 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
485 | "position": 17, | ||||
486 | "resource_type": "log", | ||||
487 | "run": 2, | ||||
488 | "size": 41503, | ||||
489 | "state": "active", | ||||
490 | "url": | ||||
491 | cessed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_log_00002.log", | ||||
492 | "url_type": null | ||||
493 | }, | ||||
494 | { | ||||
495 | "cache_last_updated": null, | ||||
496 | "cache_url": null, | ||||
497 | "created": "2023-01-31T07:03:09.269892", | ||||
498 | "description": null, | ||||
499 | "format": "edr", | ||||
500 | "hash": "", | ||||
501 | "id": "de82aeac-71d9-4951-9b10-00c33b227431", | ||||
502 | "last_modified": null, | ||||
503 | "metadata_modified": "2023-01-31T07:03:09.225430", | ||||
504 | "mimetype": null, | ||||
505 | "mimetype_inner": null, | ||||
506 | "name": | ||||
507 | sed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_energy_00002.edr", | ||||
508 | "owner_org": "mduq", | ||||
509 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
510 | "position": 18, | ||||
511 | "resource_type": "energy", | ||||
512 | "run": 2, | ||||
513 | "size": 621280, | ||||
514 | "state": "active", | ||||
515 | "url": | ||||
516 | sed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_energy_00002.edr", | ||||
517 | "url_type": null | ||||
518 | }, | ||||
519 | { | ||||
520 | "cache_last_updated": null, | ||||
521 | "cache_url": null, | ||||
522 | "created": "2023-01-31T07:03:09.269893", | ||||
523 | "description": null, | ||||
524 | "format": "tpr", | ||||
525 | "hash": "", | ||||
526 | "id": "7941199f-8ae7-49ce-a617-48c16aab0c3a", | ||||
527 | "last_modified": null, | ||||
528 | "metadata_modified": "2023-01-31T07:03:09.225537", | ||||
529 | "mimetype": null, | ||||
530 | "mimetype_inner": null, | ||||
531 | "name": | ||||
532 | cessed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_tpr_00002.tpr", | ||||
533 | "owner_org": "mduq", | ||||
534 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
535 | "position": 19, | ||||
536 | "resource_type": "tpr", | ||||
537 | "run": 2, | ||||
538 | "size": 54412496, | ||||
539 | "state": "active", | ||||
540 | "url": | ||||
541 | cessed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_tpr_00002.tpr", | ||||
542 | "url_type": null | ||||
543 | }, | ||||
544 | { | ||||
545 | "cache_last_updated": null, | ||||
546 | "cache_url": null, | ||||
547 | "created": "2023-01-31T07:03:09.269895", | ||||
548 | "description": null, | ||||
549 | "format": "top", | ||||
550 | "hash": "", | ||||
551 | "id": "7d06412f-d858-4b87-84f0-2324482c7a5d", | ||||
552 | "last_modified": null, | ||||
553 | "metadata_modified": "2023-01-31T07:03:09.225643", | ||||
554 | "mimetype": null, | ||||
555 | "mimetype_inner": null, | ||||
556 | "name": | ||||
557 | d_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_topology_00002.top", | ||||
558 | "owner_org": "mduq", | ||||
559 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
560 | "position": 20, | ||||
561 | "resource_type": "topology", | ||||
562 | "run": 2, | ||||
563 | "size": 3417, | ||||
564 | "state": "active", | ||||
565 | "url": | ||||
566 | d_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_topology_00002.top", | ||||
567 | "url_type": null | ||||
568 | }, | ||||
569 | { | ||||
570 | "cache_last_updated": null, | ||||
571 | "cache_url": null, | ||||
572 | "created": "2023-01-31T07:03:09.269896", | ||||
573 | "description": null, | ||||
574 | "format": "gro", | ||||
575 | "hash": "", | ||||
576 | "id": "fa7b9e4e-150d-48f7-9da2-9381e4e6f265", | ||||
577 | "last_modified": null, | ||||
578 | "metadata_modified": "2023-01-31T07:03:09.225750", | ||||
579 | "mimetype": null, | ||||
580 | "mimetype_inner": null, | ||||
581 | "name": | ||||
582 | ent_CBP_Irppy2acac_with-choloroform_310K_final-coordinates_00002.gro", | ||||
583 | "owner_org": "mduq", | ||||
584 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
585 | "position": 21, | ||||
586 | "resource_type": "final-coordinates", | ||||
587 | "run": 2, | ||||
588 | "size": 68494432, | ||||
589 | "state": "active", | ||||
590 | "url": | ||||
591 | ent_CBP_Irppy2acac_with-choloroform_310K_final-coordinates_00002.gro", | ||||
592 | "url_type": null | ||||
593 | }, | ||||
594 | { | ||||
595 | "cache_last_updated": null, | ||||
596 | "cache_url": null, | ||||
597 | "created": "2023-01-31T07:03:09.269897", | ||||
598 | "description": null, | ||||
599 | "format": "gro", | ||||
600 | "hash": "", | ||||
601 | "id": "b8e54e13-3086-47f7-a02d-6a7aa85173e2", | ||||
602 | "last_modified": null, | ||||
603 | "metadata_modified": "2023-01-31T07:03:09.225857", | ||||
604 | "mimetype": null, | ||||
605 | "mimetype_inner": null, | ||||
606 | "name": | ||||
607 | 6wtpercent_CBP_Irppy2acac_with-choloroform_310K_restraints_00002.gro", | ||||
608 | "owner_org": "mduq", | ||||
609 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
610 | "position": 22, | ||||
611 | "resource_type": "restraints", | ||||
612 | "run": 2, | ||||
613 | "size": 68494430, | ||||
614 | "state": "active", | ||||
615 | "url": | ||||
616 | 6wtpercent_CBP_Irppy2acac_with-choloroform_310K_restraints_00002.gro", | ||||
617 | "url_type": null | ||||
618 | }, | ||||
619 | { | ||||
620 | "cache_last_updated": null, | ||||
621 | "cache_url": null, | ||||
622 | "created": "2023-01-31T07:03:09.269899", | ||||
623 | "description": null, | ||||
624 | "format": "mdp", | ||||
625 | "hash": "", | ||||
626 | "id": "dd6fc0a5-39f5-4132-a075-15fbddd713b3", | ||||
627 | "last_modified": null, | ||||
628 | "metadata_modified": "2023-01-31T07:03:09.225964", | ||||
629 | "mimetype": null, | ||||
630 | "mimetype_inner": null, | ||||
631 | "name": | ||||
632 | ed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_control_00003.mdp", | ||||
633 | "owner_org": "mduq", | ||||
634 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
635 | "position": 23, | ||||
636 | "resource_type": "control", | ||||
637 | "run": 3, | ||||
638 | "size": 1727, | ||||
639 | "state": "active", | ||||
640 | "url": | ||||
641 | ed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_control_00003.mdp", | ||||
642 | "url_type": null | ||||
643 | }, | ||||
644 | { | ||||
645 | "cache_last_updated": null, | ||||
646 | "cache_url": null, | ||||
647 | "created": "2023-01-31T07:03:09.269900", | ||||
648 | "description": null, | ||||
649 | "format": "gro", | ||||
650 | "hash": "", | ||||
651 | "id": "1a8087e5-b08b-45ad-a203-1ca18c8c60b2", | ||||
652 | "last_modified": null, | ||||
653 | "metadata_modified": "2023-01-31T07:03:09.226070", | ||||
654 | "mimetype": null, | ||||
655 | "mimetype_inner": null, | ||||
656 | "name": | ||||
657 | ent_CBP_Irppy2acac_with-choloroform_310K_input-coordinates_00003.gro", | ||||
658 | "owner_org": "mduq", | ||||
659 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
660 | "position": 24, | ||||
661 | "resource_type": "input-coordinates", | ||||
662 | "run": 3, | ||||
663 | "size": 50560986, | ||||
664 | "state": "active", | ||||
665 | "url": | ||||
666 | ent_CBP_Irppy2acac_with-choloroform_310K_input-coordinates_00003.gro", | ||||
667 | "url_type": null | ||||
668 | }, | ||||
669 | { | ||||
670 | "cache_last_updated": null, | ||||
671 | "cache_url": null, | ||||
672 | "created": "2023-01-31T07:03:09.269901", | ||||
673 | "description": null, | ||||
674 | "format": "log", | ||||
675 | "hash": "", | ||||
676 | "id": "b1b1cde8-f31d-46cc-b346-c7a36ac52d2b", | ||||
677 | "last_modified": null, | ||||
678 | "metadata_modified": "2023-01-31T07:03:09.226177", | ||||
679 | "mimetype": null, | ||||
680 | "mimetype_inner": null, | ||||
681 | "name": | ||||
682 | cessed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_log_00003.log", | ||||
683 | "owner_org": "mduq", | ||||
684 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
685 | "position": 25, | ||||
686 | "resource_type": "log", | ||||
687 | "run": 3, | ||||
688 | "size": 32800, | ||||
689 | "state": "active", | ||||
690 | "url": | ||||
691 | cessed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_log_00003.log", | ||||
692 | "url_type": null | ||||
693 | }, | ||||
694 | { | ||||
695 | "cache_last_updated": null, | ||||
696 | "cache_url": null, | ||||
697 | "created": "2023-01-31T07:03:09.269902", | ||||
698 | "description": null, | ||||
699 | "format": "edr", | ||||
700 | "hash": "", | ||||
701 | "id": "d989085f-bbe4-4e2e-a4ca-fedc35f14f29", | ||||
702 | "last_modified": null, | ||||
703 | "metadata_modified": "2023-01-31T07:03:09.226283", | ||||
704 | "mimetype": null, | ||||
705 | "mimetype_inner": null, | ||||
706 | "name": | ||||
707 | sed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_energy_00003.edr", | ||||
708 | "owner_org": "mduq", | ||||
709 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
710 | "position": 26, | ||||
711 | "resource_type": "energy", | ||||
712 | "run": 3, | ||||
713 | "size": 249280, | ||||
714 | "state": "active", | ||||
715 | "url": | ||||
716 | sed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_energy_00003.edr", | ||||
717 | "url_type": null | ||||
718 | }, | ||||
719 | { | ||||
720 | "cache_last_updated": null, | ||||
721 | "cache_url": null, | ||||
722 | "created": "2023-01-31T07:03:09.269904", | ||||
723 | "description": null, | ||||
724 | "format": "tpr", | ||||
725 | "hash": "", | ||||
726 | "id": "91f117fb-b6b9-4cbd-a1b6-100fa4c70647", | ||||
727 | "last_modified": null, | ||||
728 | "metadata_modified": "2023-01-31T07:03:09.226389", | ||||
729 | "mimetype": null, | ||||
730 | "mimetype_inner": null, | ||||
731 | "name": | ||||
732 | cessed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_tpr_00003.tpr", | ||||
733 | "owner_org": "mduq", | ||||
734 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
735 | "position": 27, | ||||
736 | "resource_type": "tpr", | ||||
737 | "run": 3, | ||||
738 | "size": 39865376, | ||||
739 | "state": "active", | ||||
740 | "url": | ||||
741 | cessed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_tpr_00003.tpr", | ||||
742 | "url_type": null | ||||
743 | }, | ||||
744 | { | ||||
745 | "cache_last_updated": null, | ||||
746 | "cache_url": null, | ||||
747 | "created": "2023-01-31T07:03:09.269905", | ||||
748 | "description": null, | ||||
749 | "format": "top", | ||||
750 | "hash": "", | ||||
751 | "id": "9ca521a6-1f05-42ac-b4d1-9448f7052e26", | ||||
752 | "last_modified": null, | ||||
753 | "metadata_modified": "2023-01-31T07:03:09.226495", | ||||
754 | "mimetype": null, | ||||
755 | "mimetype_inner": null, | ||||
756 | "name": | ||||
757 | d_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_topology_00003.top", | ||||
758 | "owner_org": "mduq", | ||||
759 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
760 | "position": 28, | ||||
761 | "resource_type": "topology", | ||||
762 | "run": 3, | ||||
763 | "size": 3417, | ||||
764 | "state": "active", | ||||
765 | "url": | ||||
766 | d_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_topology_00003.top", | ||||
767 | "url_type": null | ||||
768 | }, | ||||
769 | { | ||||
770 | "cache_last_updated": null, | ||||
771 | "cache_url": null, | ||||
772 | "created": "2023-01-31T07:03:09.269906", | ||||
773 | "description": null, | ||||
774 | "format": "gro", | ||||
775 | "hash": "", | ||||
776 | "id": "75922715-b09c-42ac-8461-03028f6b78b5", | ||||
777 | "last_modified": null, | ||||
778 | "metadata_modified": "2023-01-31T07:03:09.226600", | ||||
779 | "mimetype": null, | ||||
780 | "mimetype_inner": null, | ||||
781 | "name": | ||||
782 | ent_CBP_Irppy2acac_with-choloroform_310K_final-coordinates_00003.gro", | ||||
783 | "owner_org": "mduq", | ||||
784 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
785 | "position": 29, | ||||
786 | "resource_type": "final-coordinates", | ||||
787 | "run": 3, | ||||
788 | "size": 50560986, | ||||
789 | "state": "active", | ||||
790 | "url": | ||||
791 | ent_CBP_Irppy2acac_with-choloroform_310K_final-coordinates_00003.gro", | ||||
792 | "url_type": null | ||||
793 | }, | ||||
794 | { | ||||
795 | "cache_last_updated": null, | ||||
796 | "cache_url": null, | ||||
797 | "created": "2023-01-31T07:03:09.269907", | ||||
798 | "description": null, | ||||
799 | "format": "gro", | ||||
800 | "hash": "", | ||||
801 | "id": "1bf1f920-608c-4fb6-bac0-ccd59e415d7f", | ||||
802 | "last_modified": null, | ||||
803 | "metadata_modified": "2023-01-31T07:03:09.226706", | ||||
804 | "mimetype": null, | ||||
805 | "mimetype_inner": null, | ||||
806 | "name": | ||||
807 | 6wtpercent_CBP_Irppy2acac_with-choloroform_310K_restraints_00003.gro", | ||||
808 | "owner_org": "mduq", | ||||
809 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
810 | "position": 30, | ||||
811 | "resource_type": "restraints", | ||||
812 | "run": 3, | ||||
813 | "size": 50560986, | ||||
814 | "state": "active", | ||||
815 | "url": | ||||
816 | 6wtpercent_CBP_Irppy2acac_with-choloroform_310K_restraints_00003.gro", | ||||
817 | "url_type": null | ||||
818 | }, | ||||
819 | { | ||||
820 | "cache_last_updated": null, | ||||
821 | "cache_url": null, | ||||
822 | "created": "2023-01-31T07:03:09.269909", | ||||
823 | "description": null, | ||||
824 | "format": "mdp", | ||||
825 | "hash": "", | ||||
826 | "id": "1f4ba767-dc5b-44ab-95e7-82e9149a2229", | ||||
827 | "last_modified": null, | ||||
828 | "metadata_modified": "2023-01-31T07:03:09.226813", | ||||
829 | "mimetype": null, | ||||
830 | "mimetype_inner": null, | ||||
831 | "name": | ||||
832 | ed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_control_00004.mdp", | ||||
833 | "owner_org": "mduq", | ||||
834 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
835 | "position": 31, | ||||
836 | "resource_type": "control", | ||||
837 | "run": 4, | ||||
838 | "size": 1729, | ||||
839 | "state": "active", | ||||
840 | "url": | ||||
841 | ed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_control_00004.mdp", | ||||
842 | "url_type": null | ||||
843 | }, | ||||
844 | { | ||||
845 | "cache_last_updated": null, | ||||
846 | "cache_url": null, | ||||
847 | "created": "2023-01-31T07:03:09.269910", | ||||
848 | "description": null, | ||||
849 | "format": "gro", | ||||
850 | "hash": "", | ||||
851 | "id": "e4628585-1d26-492f-8828-d5fbff783812", | ||||
852 | "last_modified": null, | ||||
853 | "metadata_modified": "2023-01-31T07:03:09.226919", | ||||
854 | "mimetype": null, | ||||
855 | "mimetype_inner": null, | ||||
856 | "name": | ||||
857 | ent_CBP_Irppy2acac_with-choloroform_310K_input-coordinates_00004.gro", | ||||
858 | "owner_org": "mduq", | ||||
859 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
860 | "position": 32, | ||||
861 | "resource_type": "input-coordinates", | ||||
862 | "run": 4, | ||||
863 | "size": 36863797, | ||||
864 | "state": "active", | ||||
865 | "url": | ||||
866 | ent_CBP_Irppy2acac_with-choloroform_310K_input-coordinates_00004.gro", | ||||
867 | "url_type": null | ||||
868 | }, | ||||
869 | { | ||||
870 | "cache_last_updated": null, | ||||
871 | "cache_url": null, | ||||
872 | "created": "2023-01-31T07:03:09.269911", | ||||
873 | "description": null, | ||||
874 | "format": "log", | ||||
875 | "hash": "", | ||||
876 | "id": "360bfe73-5328-4c87-9972-f822042705a3", | ||||
877 | "last_modified": null, | ||||
878 | "metadata_modified": "2023-01-31T07:03:09.227025", | ||||
879 | "mimetype": null, | ||||
880 | "mimetype_inner": null, | ||||
881 | "name": | ||||
882 | cessed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_log_00004.log", | ||||
883 | "owner_org": "mduq", | ||||
884 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
885 | "position": 33, | ||||
886 | "resource_type": "log", | ||||
887 | "run": 4, | ||||
888 | "size": 32796, | ||||
889 | "state": "active", | ||||
890 | "url": | ||||
891 | cessed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_log_00004.log", | ||||
892 | "url_type": null | ||||
893 | }, | ||||
894 | { | ||||
895 | "cache_last_updated": null, | ||||
896 | "cache_url": null, | ||||
897 | "created": "2023-01-31T07:03:09.269913", | ||||
898 | "description": null, | ||||
899 | "format": "edr", | ||||
900 | "hash": "", | ||||
901 | "id": "f50fcee6-e010-4939-be1f-ad4d54fab821", | ||||
902 | "last_modified": null, | ||||
903 | "metadata_modified": "2023-01-31T07:03:09.227132", | ||||
904 | "mimetype": null, | ||||
905 | "mimetype_inner": null, | ||||
906 | "name": | ||||
907 | sed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_energy_00004.edr", | ||||
908 | "owner_org": "mduq", | ||||
909 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
910 | "position": 34, | ||||
911 | "resource_type": "energy", | ||||
912 | "run": 4, | ||||
913 | "size": 249280, | ||||
914 | "state": "active", | ||||
915 | "url": | ||||
916 | sed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_energy_00004.edr", | ||||
917 | "url_type": null | ||||
918 | }, | ||||
919 | { | ||||
920 | "cache_last_updated": null, | ||||
921 | "cache_url": null, | ||||
922 | "created": "2023-01-31T07:03:09.269914", | ||||
923 | "description": null, | ||||
924 | "format": "tpr", | ||||
925 | "hash": "", | ||||
926 | "id": "f68ced56-abe2-4b96-9ee2-0bfe1dee3bde", | ||||
927 | "last_modified": null, | ||||
928 | "metadata_modified": "2023-01-31T07:03:09.227241", | ||||
929 | "mimetype": null, | ||||
930 | "mimetype_inner": null, | ||||
931 | "name": | ||||
932 | cessed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_tpr_00004.tpr", | ||||
933 | "owner_org": "mduq", | ||||
934 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
935 | "position": 35, | ||||
936 | "resource_type": "tpr", | ||||
937 | "run": 4, | ||||
938 | "size": 20097248, | ||||
939 | "state": "active", | ||||
940 | "url": | ||||
941 | cessed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_tpr_00004.tpr", | ||||
942 | "url_type": null | ||||
943 | }, | ||||
944 | { | ||||
945 | "cache_last_updated": null, | ||||
946 | "cache_url": null, | ||||
947 | "created": "2023-01-31T07:03:09.269915", | ||||
948 | "description": null, | ||||
949 | "format": "top", | ||||
950 | "hash": "", | ||||
951 | "id": "1c8f2abf-ef0d-467a-aec1-d8bfa2742403", | ||||
952 | "last_modified": null, | ||||
953 | "metadata_modified": "2023-01-31T07:03:09.227348", | ||||
954 | "mimetype": null, | ||||
955 | "mimetype_inner": null, | ||||
956 | "name": | ||||
957 | d_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_topology_00004.top", | ||||
958 | "owner_org": "mduq", | ||||
959 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
960 | "position": 36, | ||||
961 | "resource_type": "topology", | ||||
962 | "run": 4, | ||||
963 | "size": 3417, | ||||
964 | "state": "active", | ||||
965 | "url": | ||||
966 | d_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_topology_00004.top", | ||||
967 | "url_type": null | ||||
968 | }, | ||||
969 | { | ||||
970 | "cache_last_updated": null, | ||||
971 | "cache_url": null, | ||||
972 | "created": "2023-01-31T07:03:09.269916", | ||||
973 | "description": null, | ||||
974 | "format": "gro", | ||||
975 | "hash": "", | ||||
976 | "id": "4de5981b-87c8-49bd-b9db-d5a67cdf9a99", | ||||
977 | "last_modified": null, | ||||
978 | "metadata_modified": "2023-01-31T07:03:09.227454", | ||||
979 | "mimetype": null, | ||||
980 | "mimetype_inner": null, | ||||
981 | "name": | ||||
982 | ent_CBP_Irppy2acac_with-choloroform_310K_final-coordinates_00004.gro", | ||||
983 | "owner_org": "mduq", | ||||
984 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
985 | "position": 37, | ||||
986 | "resource_type": "final-coordinates", | ||||
987 | "run": 4, | ||||
988 | "size": 36863778, | ||||
989 | "state": "active", | ||||
990 | "url": | ||||
991 | ent_CBP_Irppy2acac_with-choloroform_310K_final-coordinates_00004.gro", | ||||
992 | "url_type": null | ||||
993 | }, | ||||
994 | { | ||||
995 | "cache_last_updated": null, | ||||
996 | "cache_url": null, | ||||
997 | "created": "2023-01-31T07:03:09.269918", | ||||
998 | "description": null, | ||||
999 | "format": "gro", | ||||
1000 | "hash": "", | ||||
1001 | "id": "38960cc7-163d-4225-84bc-aecafad4735e", | ||||
1002 | "last_modified": null, | ||||
1003 | "metadata_modified": "2023-01-31T07:03:09.227560", | ||||
1004 | "mimetype": null, | ||||
1005 | "mimetype_inner": null, | ||||
1006 | "name": | ||||
1007 | 6wtpercent_CBP_Irppy2acac_with-choloroform_310K_restraints_00004.gro", | ||||
1008 | "owner_org": "mduq", | ||||
1009 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
1010 | "position": 38, | ||||
1011 | "resource_type": "restraints", | ||||
1012 | "run": 4, | ||||
1013 | "size": 36863797, | ||||
1014 | "state": "active", | ||||
1015 | "url": | ||||
1016 | 6wtpercent_CBP_Irppy2acac_with-choloroform_310K_restraints_00004.gro", | ||||
1017 | "url_type": null | ||||
1018 | }, | ||||
1019 | { | ||||
1020 | "cache_last_updated": null, | ||||
1021 | "cache_url": null, | ||||
1022 | "created": "2023-01-31T07:03:09.269919", | ||||
1023 | "description": null, | ||||
1024 | "format": "mdp", | ||||
1025 | "hash": "", | ||||
1026 | "id": "78aa05da-c81d-4069-9989-b1061abd4593", | ||||
1027 | "last_modified": null, | ||||
1028 | "metadata_modified": "2023-01-31T07:03:09.227666", | ||||
1029 | "mimetype": null, | ||||
1030 | "mimetype_inner": null, | ||||
1031 | "name": | ||||
1032 | ed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_control_00005.mdp", | ||||
1033 | "owner_org": "mduq", | ||||
1034 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
1035 | "position": 39, | ||||
1036 | "resource_type": "control", | ||||
1037 | "run": 5, | ||||
1038 | "size": 1727, | ||||
1039 | "state": "active", | ||||
1040 | "url": | ||||
1041 | ed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_control_00005.mdp", | ||||
1042 | "url_type": null | ||||
1043 | }, | ||||
1044 | { | ||||
1045 | "cache_last_updated": null, | ||||
1046 | "cache_url": null, | ||||
1047 | "created": "2023-01-31T07:03:09.269920", | ||||
1048 | "description": null, | ||||
1049 | "format": "gro", | ||||
1050 | "hash": "", | ||||
1051 | "id": "6da079a4-a42a-4469-8120-0a9052a9d67d", | ||||
1052 | "last_modified": null, | ||||
1053 | "metadata_modified": "2023-01-31T07:03:09.227772", | ||||
1054 | "mimetype": null, | ||||
1055 | "mimetype_inner": null, | ||||
1056 | "name": | ||||
1057 | ent_CBP_Irppy2acac_with-choloroform_310K_input-coordinates_00005.gro", | ||||
1058 | "owner_org": "mduq", | ||||
1059 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
1060 | "position": 40, | ||||
1061 | "resource_type": "input-coordinates", | ||||
1062 | "run": 5, | ||||
1063 | "size": 25699597, | ||||
1064 | "state": "active", | ||||
1065 | "url": | ||||
1066 | ent_CBP_Irppy2acac_with-choloroform_310K_input-coordinates_00005.gro", | ||||
1067 | "url_type": null | ||||
1068 | }, | ||||
1069 | { | ||||
1070 | "cache_last_updated": null, | ||||
1071 | "cache_url": null, | ||||
1072 | "created": "2023-01-31T07:03:09.269921", | ||||
1073 | "description": null, | ||||
1074 | "format": "log", | ||||
1075 | "hash": "", | ||||
1076 | "id": "e7eb3513-535e-452c-b1f0-74290e6603c9", | ||||
1077 | "last_modified": null, | ||||
1078 | "metadata_modified": "2023-01-31T07:03:09.227878", | ||||
1079 | "mimetype": null, | ||||
1080 | "mimetype_inner": null, | ||||
1081 | "name": | ||||
1082 | cessed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_log_00005.log", | ||||
1083 | "owner_org": "mduq", | ||||
1084 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
1085 | "position": 41, | ||||
1086 | "resource_type": "log", | ||||
1087 | "run": 5, | ||||
1088 | "size": 32798, | ||||
1089 | "state": "active", | ||||
1090 | "url": | ||||
1091 | cessed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_log_00005.log", | ||||
1092 | "url_type": null | ||||
1093 | }, | ||||
1094 | { | ||||
1095 | "cache_last_updated": null, | ||||
1096 | "cache_url": null, | ||||
1097 | "created": "2023-01-31T07:03:09.269923", | ||||
1098 | "description": null, | ||||
1099 | "format": "edr", | ||||
1100 | "hash": "", | ||||
1101 | "id": "d10ddf61-e319-4e90-9d1a-0be8505fdb21", | ||||
1102 | "last_modified": null, | ||||
1103 | "metadata_modified": "2023-01-31T07:03:09.227984", | ||||
1104 | "mimetype": null, | ||||
1105 | "mimetype_inner": null, | ||||
1106 | "name": | ||||
1107 | sed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_energy_00005.edr", | ||||
1108 | "owner_org": "mduq", | ||||
1109 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
1110 | "position": 42, | ||||
1111 | "resource_type": "energy", | ||||
1112 | "run": 5, | ||||
1113 | "size": 249280, | ||||
1114 | "state": "active", | ||||
1115 | "url": | ||||
1116 | sed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_energy_00005.edr", | ||||
1117 | "url_type": null | ||||
1118 | }, | ||||
1119 | { | ||||
1120 | "cache_last_updated": null, | ||||
1121 | "cache_url": null, | ||||
1122 | "created": "2023-01-31T07:03:09.269924", | ||||
1123 | "description": null, | ||||
1124 | "format": "tpr", | ||||
1125 | "hash": "", | ||||
1126 | "id": "d9cdb5ac-69f1-46a5-8815-9ca661d9fc24", | ||||
1127 | "last_modified": null, | ||||
1128 | "metadata_modified": "2023-01-31T07:03:09.228093", | ||||
1129 | "mimetype": null, | ||||
1130 | "mimetype_inner": null, | ||||
1131 | "name": | ||||
1132 | cessed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_tpr_00005.tpr", | ||||
1133 | "owner_org": "mduq", | ||||
1134 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
1135 | "position": 43, | ||||
1136 | "resource_type": "tpr", | ||||
1137 | "run": 5, | ||||
1138 | "size": 15566848, | ||||
1139 | "state": "active", | ||||
1140 | "url": | ||||
1141 | cessed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_tpr_00005.tpr", | ||||
1142 | "url_type": null | ||||
1143 | }, | ||||
1144 | { | ||||
1145 | "cache_last_updated": null, | ||||
1146 | "cache_url": null, | ||||
1147 | "created": "2023-01-31T07:03:09.269925", | ||||
1148 | "description": null, | ||||
1149 | "format": "top", | ||||
1150 | "hash": "", | ||||
1151 | "id": "6300a1a3-3f7f-4741-96e8-2a14863d2db7", | ||||
1152 | "last_modified": null, | ||||
1153 | "metadata_modified": "2023-01-31T07:03:09.228199", | ||||
1154 | "mimetype": null, | ||||
1155 | "mimetype_inner": null, | ||||
1156 | "name": | ||||
1157 | d_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_topology_00005.top", | ||||
1158 | "owner_org": "mduq", | ||||
1159 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
1160 | "position": 44, | ||||
1161 | "resource_type": "topology", | ||||
1162 | "run": 5, | ||||
1163 | "size": 3412, | ||||
1164 | "state": "active", | ||||
1165 | "url": | ||||
1166 | d_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_topology_00005.top", | ||||
1167 | "url_type": null | ||||
1168 | }, | ||||
1169 | { | ||||
1170 | "cache_last_updated": null, | ||||
1171 | "cache_url": null, | ||||
1172 | "created": "2023-01-31T07:03:09.269926", | ||||
1173 | "description": null, | ||||
1174 | "format": "gro", | ||||
1175 | "hash": "", | ||||
1176 | "id": "b125fe36-4d08-4725-8c3e-2bf7b6e2ca9a", | ||||
1177 | "last_modified": null, | ||||
1178 | "metadata_modified": "2023-01-31T07:03:09.228306", | ||||
1179 | "mimetype": null, | ||||
1180 | "mimetype_inner": null, | ||||
1181 | "name": | ||||
1182 | ent_CBP_Irppy2acac_with-choloroform_310K_final-coordinates_00005.gro", | ||||
1183 | "owner_org": "mduq", | ||||
1184 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
1185 | "position": 45, | ||||
1186 | "resource_type": "final-coordinates", | ||||
1187 | "run": 5, | ||||
1188 | "size": 25699578, | ||||
1189 | "state": "active", | ||||
1190 | "url": | ||||
1191 | ent_CBP_Irppy2acac_with-choloroform_310K_final-coordinates_00005.gro", | ||||
1192 | "url_type": null | ||||
1193 | }, | ||||
1194 | { | ||||
1195 | "cache_last_updated": null, | ||||
1196 | "cache_url": null, | ||||
1197 | "created": "2023-01-31T07:03:09.269928", | ||||
1198 | "description": null, | ||||
1199 | "format": "gro", | ||||
1200 | "hash": "", | ||||
1201 | "id": "39053d11-9e38-4754-92ab-d09651364194", | ||||
1202 | "last_modified": null, | ||||
1203 | "metadata_modified": "2023-01-31T07:03:09.228413", | ||||
1204 | "mimetype": null, | ||||
1205 | "mimetype_inner": null, | ||||
1206 | "name": | ||||
1207 | 6wtpercent_CBP_Irppy2acac_with-choloroform_310K_restraints_00005.gro", | ||||
1208 | "owner_org": "mduq", | ||||
1209 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
1210 | "position": 46, | ||||
1211 | "resource_type": "restraints", | ||||
1212 | "run": 5, | ||||
1213 | "size": 25699596, | ||||
1214 | "state": "active", | ||||
1215 | "url": | ||||
1216 | 6wtpercent_CBP_Irppy2acac_with-choloroform_310K_restraints_00005.gro", | ||||
1217 | "url_type": null | ||||
1218 | }, | ||||
1219 | { | ||||
1220 | "cache_last_updated": null, | ||||
1221 | "cache_url": null, | ||||
1222 | "created": "2023-01-31T07:03:09.269929", | ||||
1223 | "description": null, | ||||
1224 | "format": "mdp", | ||||
1225 | "hash": "", | ||||
1226 | "id": "dccacc57-3276-4bfc-994f-a4facd497f2d", | ||||
1227 | "last_modified": null, | ||||
1228 | "metadata_modified": "2023-01-31T07:03:09.228520", | ||||
1229 | "mimetype": null, | ||||
1230 | "mimetype_inner": null, | ||||
1231 | "name": | ||||
1232 | ed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_control_00006.mdp", | ||||
1233 | "owner_org": "mduq", | ||||
1234 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
1235 | "position": 47, | ||||
1236 | "resource_type": "control", | ||||
1237 | "run": 6, | ||||
1238 | "size": 1729, | ||||
1239 | "state": "active", | ||||
1240 | "url": | ||||
1241 | ed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_control_00006.mdp", | ||||
1242 | "url_type": null | ||||
1243 | }, | ||||
1244 | { | ||||
1245 | "cache_last_updated": null, | ||||
1246 | "cache_url": null, | ||||
1247 | "created": "2023-01-31T07:03:09.269930", | ||||
1248 | "description": null, | ||||
1249 | "format": "gro", | ||||
1250 | "hash": "", | ||||
1251 | "id": "5e869f9f-cbf3-4084-bd5e-226ee9171bbc", | ||||
1252 | "last_modified": null, | ||||
1253 | "metadata_modified": "2023-01-31T07:03:09.228625", | ||||
1254 | "mimetype": null, | ||||
1255 | "mimetype_inner": null, | ||||
1256 | "name": | ||||
1257 | ent_CBP_Irppy2acac_with-choloroform_310K_input-coordinates_00006.gro", | ||||
1258 | "owner_org": "mduq", | ||||
1259 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
1260 | "position": 48, | ||||
1261 | "resource_type": "input-coordinates", | ||||
1262 | "run": 6, | ||||
1263 | "size": 21910462, | ||||
1264 | "state": "active", | ||||
1265 | "url": | ||||
1266 | ent_CBP_Irppy2acac_with-choloroform_310K_input-coordinates_00006.gro", | ||||
1267 | "url_type": null | ||||
1268 | }, | ||||
1269 | { | ||||
1270 | "cache_last_updated": null, | ||||
1271 | "cache_url": null, | ||||
1272 | "created": "2023-01-31T07:03:09.269931", | ||||
1273 | "description": null, | ||||
1274 | "format": "log", | ||||
1275 | "hash": "", | ||||
1276 | "id": "d9835e61-b5c8-4a3d-b4f8-7bdfe071f9fe", | ||||
1277 | "last_modified": null, | ||||
1278 | "metadata_modified": "2023-01-31T07:03:09.228732", | ||||
1279 | "mimetype": null, | ||||
1280 | "mimetype_inner": null, | ||||
1281 | "name": | ||||
1282 | cessed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_log_00006.log", | ||||
1283 | "owner_org": "mduq", | ||||
1284 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
1285 | "position": 49, | ||||
1286 | "resource_type": "log", | ||||
1287 | "run": 6, | ||||
1288 | "size": 32800, | ||||
1289 | "state": "active", | ||||
1290 | "url": | ||||
1291 | cessed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_log_00006.log", | ||||
1292 | "url_type": null | ||||
1293 | }, | ||||
1294 | { | ||||
1295 | "cache_last_updated": null, | ||||
1296 | "cache_url": null, | ||||
1297 | "created": "2023-01-31T07:03:09.269933", | ||||
1298 | "description": null, | ||||
1299 | "format": "edr", | ||||
1300 | "hash": "", | ||||
1301 | "id": "6807e7c6-41c4-4f62-8655-57402a4cda9a", | ||||
1302 | "last_modified": null, | ||||
1303 | "metadata_modified": "2023-01-31T07:03:09.228838", | ||||
1304 | "mimetype": null, | ||||
1305 | "mimetype_inner": null, | ||||
1306 | "name": | ||||
1307 | sed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_energy_00006.edr", | ||||
1308 | "owner_org": "mduq", | ||||
1309 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
1310 | "position": 50, | ||||
1311 | "resource_type": "energy", | ||||
1312 | "run": 6, | ||||
1313 | "size": 249280, | ||||
1314 | "state": "active", | ||||
1315 | "url": | ||||
1316 | sed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_energy_00006.edr", | ||||
1317 | "url_type": null | ||||
1318 | }, | ||||
1319 | { | ||||
1320 | "cache_last_updated": null, | ||||
1321 | "cache_url": null, | ||||
1322 | "created": "2023-01-31T07:03:09.269934", | ||||
1323 | "description": null, | ||||
1324 | "format": "tpr", | ||||
1325 | "hash": "", | ||||
1326 | "id": "e79432df-26aa-4b4a-87c7-b2c764d987d8", | ||||
1327 | "last_modified": null, | ||||
1328 | "metadata_modified": "2023-01-31T07:03:09.228944", | ||||
1329 | "mimetype": null, | ||||
1330 | "mimetype_inner": null, | ||||
1331 | "name": | ||||
1332 | cessed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_tpr_00006.tpr", | ||||
1333 | "owner_org": "mduq", | ||||
1334 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
1335 | "position": 51, | ||||
1336 | "resource_type": "tpr", | ||||
1337 | "run": 6, | ||||
1338 | "size": 14029228, | ||||
1339 | "state": "active", | ||||
1340 | "url": | ||||
1341 | cessed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_tpr_00006.tpr", | ||||
1342 | "url_type": null | ||||
1343 | }, | ||||
1344 | { | ||||
1345 | "cache_last_updated": null, | ||||
1346 | "cache_url": null, | ||||
1347 | "created": "2023-01-31T07:03:09.269935", | ||||
1348 | "description": null, | ||||
1349 | "format": "top", | ||||
1350 | "hash": "", | ||||
1351 | "id": "205a5250-783f-4da0-851d-34425aa84365", | ||||
1352 | "last_modified": null, | ||||
1353 | "metadata_modified": "2023-01-31T07:03:09.229050", | ||||
1354 | "mimetype": null, | ||||
1355 | "mimetype_inner": null, | ||||
1356 | "name": | ||||
1357 | d_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_topology_00006.top", | ||||
1358 | "owner_org": "mduq", | ||||
1359 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
1360 | "position": 52, | ||||
1361 | "resource_type": "topology", | ||||
1362 | "run": 6, | ||||
1363 | "size": 3412, | ||||
1364 | "state": "active", | ||||
1365 | "url": | ||||
1366 | d_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_topology_00006.top", | ||||
1367 | "url_type": null | ||||
1368 | }, | ||||
1369 | { | ||||
1370 | "cache_last_updated": null, | ||||
1371 | "cache_url": null, | ||||
1372 | "created": "2023-01-31T07:03:09.269937", | ||||
1373 | "description": null, | ||||
1374 | "format": "gro", | ||||
1375 | "hash": "", | ||||
1376 | "id": "60f6053c-9b00-433a-b9e3-c004bbcfaf1d", | ||||
1377 | "last_modified": null, | ||||
1378 | "metadata_modified": "2023-01-31T07:03:09.229156", | ||||
1379 | "mimetype": null, | ||||
1380 | "mimetype_inner": null, | ||||
1381 | "name": | ||||
1382 | ent_CBP_Irppy2acac_with-choloroform_310K_final-coordinates_00006.gro", | ||||
1383 | "owner_org": "mduq", | ||||
1384 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
1385 | "position": 53, | ||||
1386 | "resource_type": "final-coordinates", | ||||
1387 | "run": 6, | ||||
1388 | "size": 21910443, | ||||
1389 | "state": "active", | ||||
1390 | "url": | ||||
1391 | ent_CBP_Irppy2acac_with-choloroform_310K_final-coordinates_00006.gro", | ||||
1392 | "url_type": null | ||||
1393 | }, | ||||
1394 | { | ||||
1395 | "cache_last_updated": null, | ||||
1396 | "cache_url": null, | ||||
1397 | "created": "2023-01-31T07:03:09.269938", | ||||
1398 | "description": null, | ||||
1399 | "format": "gro", | ||||
1400 | "hash": "", | ||||
1401 | "id": "a27cff16-2061-4c61-b66e-365a4d478222", | ||||
1402 | "last_modified": null, | ||||
1403 | "metadata_modified": "2023-01-31T07:03:09.229272", | ||||
1404 | "mimetype": null, | ||||
1405 | "mimetype_inner": null, | ||||
1406 | "name": | ||||
1407 | 6wtpercent_CBP_Irppy2acac_with-choloroform_310K_restraints_00006.gro", | ||||
1408 | "owner_org": "mduq", | ||||
1409 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
1410 | "position": 54, | ||||
1411 | "resource_type": "restraints", | ||||
1412 | "run": 6, | ||||
1413 | "size": 21910461, | ||||
1414 | "state": "active", | ||||
1415 | "url": | ||||
1416 | 6wtpercent_CBP_Irppy2acac_with-choloroform_310K_restraints_00006.gro", | ||||
1417 | "url_type": null | ||||
1418 | }, | ||||
1419 | { | ||||
1420 | "cache_last_updated": null, | ||||
1421 | "cache_url": null, | ||||
1422 | "created": "2023-01-31T07:03:09.269939", | ||||
1423 | "description": null, | ||||
1424 | "format": "mdp", | ||||
1425 | "hash": "", | ||||
1426 | "id": "d5096df0-d7d2-49af-bb27-df078082e44a", | ||||
1427 | "last_modified": null, | ||||
1428 | "metadata_modified": "2023-01-31T07:03:09.229380", | ||||
1429 | "mimetype": null, | ||||
1430 | "mimetype_inner": null, | ||||
1431 | "name": | ||||
1432 | ed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_control_00007.mdp", | ||||
1433 | "owner_org": "mduq", | ||||
1434 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
1435 | "position": 55, | ||||
1436 | "resource_type": "control", | ||||
1437 | "run": 7, | ||||
1438 | "size": 1727, | ||||
1439 | "state": "active", | ||||
1440 | "url": | ||||
1441 | ed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_control_00007.mdp", | ||||
1442 | "url_type": null | ||||
1443 | }, | ||||
1444 | { | ||||
1445 | "cache_last_updated": null, | ||||
1446 | "cache_url": null, | ||||
1447 | "created": "2023-01-31T07:03:09.269940", | ||||
1448 | "description": null, | ||||
1449 | "format": "gro", | ||||
1450 | "hash": "", | ||||
1451 | "id": "40c3dd97-0754-432f-b019-bf7db3dd44e1", | ||||
1452 | "last_modified": null, | ||||
1453 | "metadata_modified": "2023-01-31T07:03:09.229487", | ||||
1454 | "mimetype": null, | ||||
1455 | "mimetype_inner": null, | ||||
1456 | "name": | ||||
1457 | ent_CBP_Irppy2acac_with-choloroform_310K_input-coordinates_00007.gro", | ||||
1458 | "owner_org": "mduq", | ||||
1459 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
1460 | "position": 56, | ||||
1461 | "resource_type": "input-coordinates", | ||||
1462 | "run": 7, | ||||
1463 | "size": 21074420, | ||||
1464 | "state": "active", | ||||
1465 | "url": | ||||
1466 | ent_CBP_Irppy2acac_with-choloroform_310K_input-coordinates_00007.gro", | ||||
1467 | "url_type": null | ||||
1468 | }, | ||||
1469 | { | ||||
1470 | "cache_last_updated": null, | ||||
1471 | "cache_url": null, | ||||
1472 | "created": "2023-01-31T07:03:09.269942", | ||||
1473 | "description": null, | ||||
1474 | "format": "log", | ||||
1475 | "hash": "", | ||||
1476 | "id": "eae4c1e7-a7f7-43b3-8a07-10ab50ccee68", | ||||
1477 | "last_modified": null, | ||||
1478 | "metadata_modified": "2023-01-31T07:03:09.229593", | ||||
1479 | "mimetype": null, | ||||
1480 | "mimetype_inner": null, | ||||
1481 | "name": | ||||
1482 | cessed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_log_00007.log", | ||||
1483 | "owner_org": "mduq", | ||||
1484 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
1485 | "position": 57, | ||||
1486 | "resource_type": "log", | ||||
1487 | "run": 7, | ||||
1488 | "size": 32798, | ||||
1489 | "state": "active", | ||||
1490 | "url": | ||||
1491 | cessed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_log_00007.log", | ||||
1492 | "url_type": null | ||||
1493 | }, | ||||
1494 | { | ||||
1495 | "cache_last_updated": null, | ||||
1496 | "cache_url": null, | ||||
1497 | "created": "2023-01-31T07:03:09.269943", | ||||
1498 | "description": null, | ||||
1499 | "format": "edr", | ||||
1500 | "hash": "", | ||||
1501 | "id": "e4895667-0b6f-4eff-b914-221bf8ddca6a", | ||||
1502 | "last_modified": null, | ||||
1503 | "metadata_modified": "2023-01-31T07:03:09.229699", | ||||
1504 | "mimetype": null, | ||||
1505 | "mimetype_inner": null, | ||||
1506 | "name": | ||||
1507 | sed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_energy_00007.edr", | ||||
1508 | "owner_org": "mduq", | ||||
1509 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
1510 | "position": 58, | ||||
1511 | "resource_type": "energy", | ||||
1512 | "run": 7, | ||||
1513 | "size": 249280, | ||||
1514 | "state": "active", | ||||
1515 | "url": | ||||
1516 | sed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_energy_00007.edr", | ||||
1517 | "url_type": null | ||||
1518 | }, | ||||
1519 | { | ||||
1520 | "cache_last_updated": null, | ||||
1521 | "cache_url": null, | ||||
1522 | "created": "2023-01-31T07:03:09.269944", | ||||
1523 | "description": null, | ||||
1524 | "format": "tpr", | ||||
1525 | "hash": "", | ||||
1526 | "id": "c5fd222b-a572-4f58-b9c6-59d9d3eb55a8", | ||||
1527 | "last_modified": null, | ||||
1528 | "metadata_modified": "2023-01-31T07:03:09.229804", | ||||
1529 | "mimetype": null, | ||||
1530 | "mimetype_inner": null, | ||||
1531 | "name": | ||||
1532 | cessed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_tpr_00007.tpr", | ||||
1533 | "owner_org": "mduq", | ||||
1534 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
1535 | "position": 59, | ||||
1536 | "resource_type": "tpr", | ||||
1537 | "run": 7, | ||||
1538 | "size": 13815728, | ||||
1539 | "state": "active", | ||||
1540 | "url": | ||||
1541 | cessed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_tpr_00007.tpr", | ||||
1542 | "url_type": null | ||||
1543 | }, | ||||
1544 | { | ||||
1545 | "cache_last_updated": null, | ||||
1546 | "cache_url": null, | ||||
1547 | "created": "2023-01-31T07:03:09.269945", | ||||
1548 | "description": null, | ||||
1549 | "format": "top", | ||||
1550 | "hash": "", | ||||
1551 | "id": "9636cfd0-9bd4-4dfc-aa26-6f23f394d604", | ||||
1552 | "last_modified": null, | ||||
1553 | "metadata_modified": "2023-01-31T07:03:09.229909", | ||||
1554 | "mimetype": null, | ||||
1555 | "mimetype_inner": null, | ||||
1556 | "name": | ||||
1557 | d_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_topology_00007.top", | ||||
1558 | "owner_org": "mduq", | ||||
1559 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
1560 | "position": 60, | ||||
1561 | "resource_type": "topology", | ||||
1562 | "run": 7, | ||||
1563 | "size": 3412, | ||||
1564 | "state": "active", | ||||
1565 | "url": | ||||
1566 | d_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_topology_00007.top", | ||||
1567 | "url_type": null | ||||
1568 | }, | ||||
1569 | { | ||||
1570 | "cache_last_updated": null, | ||||
1571 | "cache_url": null, | ||||
1572 | "created": "2023-01-31T07:03:09.269947", | ||||
1573 | "description": null, | ||||
1574 | "format": "gro", | ||||
1575 | "hash": "", | ||||
1576 | "id": "7bca2c86-f698-4dc1-a262-f46258c06a1e", | ||||
1577 | "last_modified": null, | ||||
1578 | "metadata_modified": "2023-01-31T07:03:09.230015", | ||||
1579 | "mimetype": null, | ||||
1580 | "mimetype_inner": null, | ||||
1581 | "name": | ||||
1582 | ent_CBP_Irppy2acac_with-choloroform_310K_final-coordinates_00007.gro", | ||||
1583 | "owner_org": "mduq", | ||||
1584 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
1585 | "position": 61, | ||||
1586 | "resource_type": "final-coordinates", | ||||
1587 | "run": 7, | ||||
1588 | "size": 21074401, | ||||
1589 | "state": "active", | ||||
1590 | "url": | ||||
1591 | ent_CBP_Irppy2acac_with-choloroform_310K_final-coordinates_00007.gro", | ||||
1592 | "url_type": null | ||||
1593 | }, | ||||
1594 | { | ||||
1595 | "cache_last_updated": null, | ||||
1596 | "cache_url": null, | ||||
1597 | "created": "2023-01-31T07:03:09.269948", | ||||
1598 | "description": null, | ||||
1599 | "format": "gro", | ||||
1600 | "hash": "", | ||||
1601 | "id": "c62d8ec2-e0e1-4305-ae57-dc4e0d1ae47e", | ||||
1602 | "last_modified": null, | ||||
1603 | "metadata_modified": "2023-01-31T07:03:09.230121", | ||||
1604 | "mimetype": null, | ||||
1605 | "mimetype_inner": null, | ||||
1606 | "name": | ||||
1607 | 6wtpercent_CBP_Irppy2acac_with-choloroform_310K_restraints_00007.gro", | ||||
1608 | "owner_org": "mduq", | ||||
1609 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
1610 | "position": 62, | ||||
1611 | "resource_type": "restraints", | ||||
1612 | "run": 7, | ||||
1613 | "size": 21384336, | ||||
1614 | "state": "active", | ||||
1615 | "url": | ||||
1616 | 6wtpercent_CBP_Irppy2acac_with-choloroform_310K_restraints_00007.gro", | ||||
1617 | "url_type": null | ||||
1618 | }, | ||||
1619 | { | ||||
1620 | "cache_last_updated": null, | ||||
1621 | "cache_url": null, | ||||
1622 | "created": "2023-01-31T07:03:09.269949", | ||||
1623 | "description": null, | ||||
1624 | "format": "mdp", | ||||
1625 | "hash": "", | ||||
1626 | "id": "dfb6b022-be37-4c32-925e-69b3963cfbfa", | ||||
1627 | "last_modified": null, | ||||
1628 | "metadata_modified": "2023-01-31T07:03:09.230559", | ||||
1629 | "mimetype": null, | ||||
1630 | "mimetype_inner": null, | ||||
1631 | "name": | ||||
1632 | ed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_control_00008.mdp", | ||||
1633 | "owner_org": "mduq", | ||||
1634 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
1635 | "position": 63, | ||||
1636 | "resource_type": "control", | ||||
1637 | "run": 8, | ||||
1638 | "size": 1727, | ||||
1639 | "state": "active", | ||||
1640 | "url": | ||||
1641 | ed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_control_00008.mdp", | ||||
1642 | "url_type": null | ||||
1643 | }, | ||||
1644 | { | ||||
1645 | "cache_last_updated": null, | ||||
1646 | "cache_url": null, | ||||
1647 | "created": "2023-01-31T07:03:09.269950", | ||||
1648 | "description": null, | ||||
1649 | "format": "gro", | ||||
1650 | "hash": "", | ||||
1651 | "id": "043415a5-ce52-458a-8d04-15be15415a44", | ||||
1652 | "last_modified": null, | ||||
1653 | "metadata_modified": "2023-01-31T07:03:09.230706", | ||||
1654 | "mimetype": null, | ||||
1655 | "mimetype_inner": null, | ||||
1656 | "name": | ||||
1657 | ent_CBP_Irppy2acac_with-choloroform_310K_input-coordinates_00008.gro", | ||||
1658 | "owner_org": "mduq", | ||||
1659 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
1660 | "position": 64, | ||||
1661 | "resource_type": "input-coordinates", | ||||
1662 | "run": 8, | ||||
1663 | "size": 20273782, | ||||
1664 | "state": "active", | ||||
1665 | "url": | ||||
1666 | ent_CBP_Irppy2acac_with-choloroform_310K_input-coordinates_00008.gro", | ||||
1667 | "url_type": null | ||||
1668 | }, | ||||
1669 | { | ||||
1670 | "cache_last_updated": null, | ||||
1671 | "cache_url": null, | ||||
1672 | "created": "2023-01-31T07:03:09.269952", | ||||
1673 | "description": null, | ||||
1674 | "format": "log", | ||||
1675 | "hash": "", | ||||
1676 | "id": "caa17248-1221-4679-8f71-fd94cf1ab713", | ||||
1677 | "last_modified": null, | ||||
1678 | "metadata_modified": "2023-01-31T07:03:09.230823", | ||||
1679 | "mimetype": null, | ||||
1680 | "mimetype_inner": null, | ||||
1681 | "name": | ||||
1682 | cessed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_log_00008.log", | ||||
1683 | "owner_org": "mduq", | ||||
1684 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
1685 | "position": 65, | ||||
1686 | "resource_type": "log", | ||||
1687 | "run": 8, | ||||
1688 | "size": 36685, | ||||
1689 | "state": "active", | ||||
1690 | "url": | ||||
1691 | cessed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_log_00008.log", | ||||
1692 | "url_type": null | ||||
1693 | }, | ||||
1694 | { | ||||
1695 | "cache_last_updated": null, | ||||
1696 | "cache_url": null, | ||||
1697 | "created": "2023-01-31T07:03:09.269953", | ||||
1698 | "description": null, | ||||
1699 | "format": "edr", | ||||
1700 | "hash": "", | ||||
1701 | "id": "9b73ad88-2432-4414-9d65-eafbeff31cd2", | ||||
1702 | "last_modified": null, | ||||
1703 | "metadata_modified": "2023-01-31T07:03:09.230936", | ||||
1704 | "mimetype": null, | ||||
1705 | "mimetype_inner": null, | ||||
1706 | "name": | ||||
1707 | sed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_energy_00008.edr", | ||||
1708 | "owner_org": "mduq", | ||||
1709 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
1710 | "position": 66, | ||||
1711 | "resource_type": "energy", | ||||
1712 | "run": 8, | ||||
1713 | "size": 497280, | ||||
1714 | "state": "active", | ||||
1715 | "url": | ||||
1716 | sed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_energy_00008.edr", | ||||
1717 | "url_type": null | ||||
1718 | }, | ||||
1719 | { | ||||
1720 | "cache_last_updated": null, | ||||
1721 | "cache_url": null, | ||||
1722 | "created": "2023-01-31T07:03:09.269954", | ||||
1723 | "description": null, | ||||
1724 | "format": "tpr", | ||||
1725 | "hash": "", | ||||
1726 | "id": "24ab114a-0811-493b-8102-bef572052145", | ||||
1727 | "last_modified": null, | ||||
1728 | "metadata_modified": "2023-01-31T07:03:09.231048", | ||||
1729 | "mimetype": null, | ||||
1730 | "mimetype_inner": null, | ||||
1731 | "name": | ||||
1732 | cessed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_tpr_00008.tpr", | ||||
1733 | "owner_org": "mduq", | ||||
1734 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
1735 | "position": 67, | ||||
1736 | "resource_type": "tpr", | ||||
1737 | "run": 8, | ||||
1738 | "size": 13365068, | ||||
1739 | "state": "active", | ||||
1740 | "url": | ||||
1741 | cessed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_tpr_00008.tpr", | ||||
1742 | "url_type": null | ||||
1743 | }, | ||||
1744 | { | ||||
1745 | "cache_last_updated": null, | ||||
1746 | "cache_url": null, | ||||
1747 | "created": "2023-01-31T07:03:09.269955", | ||||
1748 | "description": null, | ||||
1749 | "format": "top", | ||||
1750 | "hash": "", | ||||
1751 | "id": "bc32ca21-aa3c-4151-bd98-08093e4455fb", | ||||
1752 | "last_modified": null, | ||||
1753 | "metadata_modified": "2023-01-31T07:03:09.231158", | ||||
1754 | "mimetype": null, | ||||
1755 | "mimetype_inner": null, | ||||
1756 | "name": | ||||
1757 | d_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_topology_00008.top", | ||||
1758 | "owner_org": "mduq", | ||||
1759 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
1760 | "position": 68, | ||||
1761 | "resource_type": "topology", | ||||
1762 | "run": 8, | ||||
1763 | "size": 3413, | ||||
1764 | "state": "active", | ||||
1765 | "url": | ||||
1766 | d_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_topology_00008.top", | ||||
1767 | "url_type": null | ||||
1768 | }, | ||||
1769 | { | ||||
1770 | "cache_last_updated": null, | ||||
1771 | "cache_url": null, | ||||
1772 | "created": "2023-01-31T07:03:09.269957", | ||||
1773 | "description": null, | ||||
1774 | "format": "gro", | ||||
1775 | "hash": "", | ||||
1776 | "id": "86518921-9e57-42be-b3e4-88b8184dcfea", | ||||
1777 | "last_modified": null, | ||||
1778 | "metadata_modified": "2023-01-31T07:03:09.231268", | ||||
1779 | "mimetype": null, | ||||
1780 | "mimetype_inner": null, | ||||
1781 | "name": | ||||
1782 | ent_CBP_Irppy2acac_with-choloroform_310K_final-coordinates_00008.gro", | ||||
1783 | "owner_org": "mduq", | ||||
1784 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
1785 | "position": 69, | ||||
1786 | "resource_type": "final-coordinates", | ||||
1787 | "run": 8, | ||||
1788 | "size": 20273763, | ||||
1789 | "state": "active", | ||||
1790 | "url": | ||||
1791 | ent_CBP_Irppy2acac_with-choloroform_310K_final-coordinates_00008.gro", | ||||
1792 | "url_type": null | ||||
1793 | }, | ||||
1794 | { | ||||
1795 | "cache_last_updated": null, | ||||
1796 | "cache_url": null, | ||||
1797 | "created": "2023-01-31T07:03:09.269958", | ||||
1798 | "description": null, | ||||
1799 | "format": "gro", | ||||
1800 | "hash": "", | ||||
1801 | "id": "b0079183-e183-4d0a-b07c-05cbf3f33181", | ||||
1802 | "last_modified": null, | ||||
1803 | "metadata_modified": "2023-01-31T07:03:09.231378", | ||||
1804 | "mimetype": null, | ||||
1805 | "mimetype_inner": null, | ||||
1806 | "name": | ||||
1807 | 6wtpercent_CBP_Irppy2acac_with-choloroform_310K_restraints_00008.gro", | ||||
1808 | "owner_org": "mduq", | ||||
1809 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
1810 | "position": 70, | ||||
1811 | "resource_type": "restraints", | ||||
1812 | "run": 8, | ||||
1813 | "size": 20273781, | ||||
1814 | "state": "active", | ||||
1815 | "url": | ||||
1816 | 6wtpercent_CBP_Irppy2acac_with-choloroform_310K_restraints_00008.gro", | ||||
1817 | "url_type": null | ||||
1818 | }, | ||||
1819 | { | ||||
1820 | "cache_last_updated": null, | ||||
1821 | "cache_url": null, | ||||
1822 | "created": "2023-01-31T07:03:09.269959", | ||||
1823 | "description": null, | ||||
1824 | "format": "mdp", | ||||
1825 | "hash": "", | ||||
1826 | "id": "4248e914-0486-40e0-8e67-3d6c270e9db4", | ||||
1827 | "last_modified": null, | ||||
1828 | "metadata_modified": "2023-01-31T07:03:09.231486", | ||||
1829 | "mimetype": null, | ||||
1830 | "mimetype_inner": null, | ||||
1831 | "name": | ||||
1832 | ed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_control_00009.mdp", | ||||
1833 | "owner_org": "mduq", | ||||
1834 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
1835 | "position": 71, | ||||
1836 | "resource_type": "control", | ||||
1837 | "run": 9, | ||||
1838 | "size": 1728, | ||||
1839 | "state": "active", | ||||
1840 | "url": | ||||
1841 | ed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_control_00009.mdp", | ||||
1842 | "url_type": null | ||||
1843 | }, | ||||
1844 | { | ||||
1845 | "cache_last_updated": null, | ||||
1846 | "cache_url": null, | ||||
1847 | "created": "2023-01-31T07:03:09.269960", | ||||
1848 | "description": null, | ||||
1849 | "format": "gro", | ||||
1850 | "hash": "", | ||||
1851 | "id": "2fc2efb6-fa9a-4642-b435-a647efa2a293", | ||||
1852 | "last_modified": null, | ||||
1853 | "metadata_modified": "2023-01-31T07:03:09.231595", | ||||
1854 | "mimetype": null, | ||||
1855 | "mimetype_inner": null, | ||||
1856 | "name": | ||||
1857 | ent_CBP_Irppy2acac_with-choloroform_310K_input-coordinates_00009.gro", | ||||
1858 | "owner_org": "mduq", | ||||
1859 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
1860 | "position": 72, | ||||
1861 | "resource_type": "input-coordinates", | ||||
1862 | "run": 9, | ||||
1863 | "size": 19896007, | ||||
1864 | "state": "active", | ||||
1865 | "url": | ||||
1866 | ent_CBP_Irppy2acac_with-choloroform_310K_input-coordinates_00009.gro", | ||||
1867 | "url_type": null | ||||
1868 | }, | ||||
1869 | { | ||||
1870 | "cache_last_updated": null, | ||||
1871 | "cache_url": null, | ||||
1872 | "created": "2023-01-31T07:03:09.269962", | ||||
1873 | "description": null, | ||||
1874 | "format": "log", | ||||
1875 | "hash": "", | ||||
1876 | "id": "0719254b-87bb-472b-9f7a-42b7e42711f9", | ||||
1877 | "last_modified": null, | ||||
1878 | "metadata_modified": "2023-01-31T07:03:09.231704", | ||||
1879 | "mimetype": null, | ||||
1880 | "mimetype_inner": null, | ||||
1881 | "name": | ||||
1882 | cessed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_log_00009.log", | ||||
1883 | "owner_org": "mduq", | ||||
1884 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
1885 | "position": 73, | ||||
1886 | "resource_type": "log", | ||||
1887 | "run": 9, | ||||
1888 | "size": 36686, | ||||
1889 | "state": "active", | ||||
1890 | "url": | ||||
1891 | cessed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_log_00009.log", | ||||
1892 | "url_type": null | ||||
1893 | }, | ||||
1894 | { | ||||
1895 | "cache_last_updated": null, | ||||
1896 | "cache_url": null, | ||||
1897 | "created": "2023-01-31T07:03:09.269963", | ||||
1898 | "description": null, | ||||
1899 | "format": "edr", | ||||
1900 | "hash": "", | ||||
1901 | "id": "655eb208-906b-4c3c-8c7c-758f6ed91331", | ||||
1902 | "last_modified": null, | ||||
1903 | "metadata_modified": "2023-01-31T07:03:09.231811", | ||||
1904 | "mimetype": null, | ||||
1905 | "mimetype_inner": null, | ||||
1906 | "name": | ||||
1907 | sed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_energy_00009.edr", | ||||
1908 | "owner_org": "mduq", | ||||
1909 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
1910 | "position": 74, | ||||
1911 | "resource_type": "energy", | ||||
1912 | "run": 9, | ||||
1913 | "size": 497280, | ||||
1914 | "state": "active", | ||||
1915 | "url": | ||||
1916 | sed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_energy_00009.edr", | ||||
1917 | "url_type": null | ||||
1918 | }, | ||||
1919 | { | ||||
1920 | "cache_last_updated": null, | ||||
1921 | "cache_url": null, | ||||
1922 | "created": "2023-01-31T07:03:09.269964", | ||||
1923 | "description": null, | ||||
1924 | "format": "tpr", | ||||
1925 | "hash": "", | ||||
1926 | "id": "2bcd1cb4-6883-4aa4-b1e0-575101c517e6", | ||||
1927 | "last_modified": null, | ||||
1928 | "metadata_modified": "2023-01-31T07:03:09.231918", | ||||
1929 | "mimetype": null, | ||||
1930 | "mimetype_inner": null, | ||||
1931 | "name": | ||||
1932 | cessed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_tpr_00009.tpr", | ||||
1933 | "owner_org": "mduq", | ||||
1934 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
1935 | "position": 75, | ||||
1936 | "resource_type": "tpr", | ||||
1937 | "run": 9, | ||||
1938 | "size": 13211768, | ||||
1939 | "state": "active", | ||||
1940 | "url": | ||||
1941 | cessed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_tpr_00009.tpr", | ||||
1942 | "url_type": null | ||||
1943 | }, | ||||
1944 | { | ||||
1945 | "cache_last_updated": null, | ||||
1946 | "cache_url": null, | ||||
1947 | "created": "2023-01-31T07:03:09.269966", | ||||
1948 | "description": null, | ||||
1949 | "format": "top", | ||||
1950 | "hash": "", | ||||
1951 | "id": "0f165394-3dba-4cab-a1e8-ec8062d2afbb", | ||||
1952 | "last_modified": null, | ||||
1953 | "metadata_modified": "2023-01-31T07:03:09.232025", | ||||
1954 | "mimetype": null, | ||||
1955 | "mimetype_inner": null, | ||||
1956 | "name": | ||||
1957 | d_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_topology_00009.top", | ||||
1958 | "owner_org": "mduq", | ||||
1959 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
1960 | "position": 76, | ||||
1961 | "resource_type": "topology", | ||||
1962 | "run": 9, | ||||
1963 | "size": 3412, | ||||
1964 | "state": "active", | ||||
1965 | "url": | ||||
1966 | d_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_topology_00009.top", | ||||
1967 | "url_type": null | ||||
1968 | }, | ||||
1969 | { | ||||
1970 | "cache_last_updated": null, | ||||
1971 | "cache_url": null, | ||||
1972 | "created": "2023-01-31T07:03:09.269967", | ||||
1973 | "description": null, | ||||
1974 | "format": "gro", | ||||
1975 | "hash": "", | ||||
1976 | "id": "628aa6cb-f190-4ea9-b92e-8bbb6a2f07f1", | ||||
1977 | "last_modified": null, | ||||
1978 | "metadata_modified": "2023-01-31T07:03:09.232132", | ||||
1979 | "mimetype": null, | ||||
1980 | "mimetype_inner": null, | ||||
1981 | "name": | ||||
1982 | ent_CBP_Irppy2acac_with-choloroform_310K_final-coordinates_00009.gro", | ||||
1983 | "owner_org": "mduq", | ||||
1984 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
1985 | "position": 77, | ||||
1986 | "resource_type": "final-coordinates", | ||||
1987 | "run": 9, | ||||
1988 | "size": 19895988, | ||||
1989 | "state": "active", | ||||
1990 | "url": | ||||
1991 | ent_CBP_Irppy2acac_with-choloroform_310K_final-coordinates_00009.gro", | ||||
1992 | "url_type": null | ||||
1993 | }, | ||||
1994 | { | ||||
1995 | "cache_last_updated": null, | ||||
1996 | "cache_url": null, | ||||
1997 | "created": "2023-01-31T07:03:09.269968", | ||||
1998 | "description": null, | ||||
1999 | "format": "gro", | ||||
2000 | "hash": "", | ||||
2001 | "id": "19ca0773-c115-417f-b64c-5cf03a72dbeb", | ||||
2002 | "last_modified": null, | ||||
2003 | "metadata_modified": "2023-01-31T07:03:09.232239", | ||||
2004 | "mimetype": null, | ||||
2005 | "mimetype_inner": null, | ||||
2006 | "name": | ||||
2007 | 6wtpercent_CBP_Irppy2acac_with-choloroform_310K_restraints_00009.gro", | ||||
2008 | "owner_org": "mduq", | ||||
2009 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
2010 | "position": 78, | ||||
2011 | "resource_type": "restraints", | ||||
2012 | "run": 9, | ||||
2013 | "size": 19896006, | ||||
2014 | "state": "active", | ||||
2015 | "url": | ||||
2016 | 6wtpercent_CBP_Irppy2acac_with-choloroform_310K_restraints_00009.gro", | ||||
2017 | "url_type": null | ||||
2018 | }, | ||||
2019 | { | ||||
2020 | "cache_last_updated": null, | ||||
2021 | "cache_url": null, | ||||
2022 | "created": "2023-01-31T07:03:09.269969", | ||||
2023 | "description": null, | ||||
2024 | "format": "mdp", | ||||
2025 | "hash": "", | ||||
2026 | "id": "af0d48e2-633a-40ac-85bb-0a11a26a65ed", | ||||
2027 | "last_modified": null, | ||||
2028 | "metadata_modified": "2023-01-31T07:03:09.232346", | ||||
2029 | "mimetype": null, | ||||
2030 | "mimetype_inner": null, | ||||
2031 | "name": | ||||
2032 | ed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_control_00010.mdp", | ||||
2033 | "owner_org": "mduq", | ||||
2034 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
2035 | "position": 79, | ||||
2036 | "resource_type": "control", | ||||
2037 | "run": 10, | ||||
2038 | "size": 1728, | ||||
2039 | "state": "active", | ||||
2040 | "url": | ||||
2041 | ed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_control_00010.mdp", | ||||
2042 | "url_type": null | ||||
2043 | }, | ||||
2044 | { | ||||
2045 | "cache_last_updated": null, | ||||
2046 | "cache_url": null, | ||||
2047 | "created": "2023-01-31T07:03:09.269971", | ||||
2048 | "description": null, | ||||
2049 | "format": "gro", | ||||
2050 | "hash": "", | ||||
2051 | "id": "b1b4fb0c-77ae-4ff4-98ac-dd47f641c5e1", | ||||
2052 | "last_modified": null, | ||||
2053 | "metadata_modified": "2023-01-31T07:03:09.232451", | ||||
2054 | "mimetype": null, | ||||
2055 | "mimetype_inner": null, | ||||
2056 | "name": | ||||
2057 | ent_CBP_Irppy2acac_with-choloroform_310K_input-coordinates_00010.gro", | ||||
2058 | "owner_org": "mduq", | ||||
2059 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
2060 | "position": 80, | ||||
2061 | "resource_type": "input-coordinates", | ||||
2062 | "run": 10, | ||||
2063 | "size": 19694527, | ||||
2064 | "state": "active", | ||||
2065 | "url": | ||||
2066 | ent_CBP_Irppy2acac_with-choloroform_310K_input-coordinates_00010.gro", | ||||
2067 | "url_type": null | ||||
2068 | }, | ||||
2069 | { | ||||
2070 | "cache_last_updated": null, | ||||
2071 | "cache_url": null, | ||||
2072 | "created": "2023-01-31T07:03:09.269972", | ||||
2073 | "description": null, | ||||
2074 | "format": "log", | ||||
2075 | "hash": "", | ||||
2076 | "id": "e0f0e6a8-8e01-4a89-82ee-dab1e77a2c62", | ||||
2077 | "last_modified": null, | ||||
2078 | "metadata_modified": "2023-01-31T07:03:09.232557", | ||||
2079 | "mimetype": null, | ||||
2080 | "mimetype_inner": null, | ||||
2081 | "name": | ||||
2082 | cessed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_log_00010.log", | ||||
2083 | "owner_org": "mduq", | ||||
2084 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
2085 | "position": 81, | ||||
2086 | "resource_type": "log", | ||||
2087 | "run": 10, | ||||
2088 | "size": 36685, | ||||
2089 | "state": "active", | ||||
2090 | "url": | ||||
2091 | cessed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_log_00010.log", | ||||
2092 | "url_type": null | ||||
2093 | }, | ||||
2094 | { | ||||
2095 | "cache_last_updated": null, | ||||
2096 | "cache_url": null, | ||||
2097 | "created": "2023-01-31T07:03:09.269973", | ||||
2098 | "description": null, | ||||
2099 | "format": "edr", | ||||
2100 | "hash": "", | ||||
2101 | "id": "10c6c22a-9639-4ac2-98f8-3abd99291be7", | ||||
2102 | "last_modified": null, | ||||
2103 | "metadata_modified": "2023-01-31T07:03:09.232664", | ||||
2104 | "mimetype": null, | ||||
2105 | "mimetype_inner": null, | ||||
2106 | "name": | ||||
2107 | sed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_energy_00010.edr", | ||||
2108 | "owner_org": "mduq", | ||||
2109 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
2110 | "position": 82, | ||||
2111 | "resource_type": "energy", | ||||
2112 | "run": 10, | ||||
2113 | "size": 497280, | ||||
2114 | "state": "active", | ||||
2115 | "url": | ||||
2116 | sed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_energy_00010.edr", | ||||
2117 | "url_type": null | ||||
2118 | }, | ||||
2119 | { | ||||
2120 | "cache_last_updated": null, | ||||
2121 | "cache_url": null, | ||||
2122 | "created": "2023-01-31T07:03:09.269975", | ||||
2123 | "description": null, | ||||
2124 | "format": "tpr", | ||||
2125 | "hash": "", | ||||
2126 | "id": "a22c65e7-04f7-4f33-94b9-8aaa7275d45c", | ||||
2127 | "last_modified": null, | ||||
2128 | "metadata_modified": "2023-01-31T07:03:09.232770", | ||||
2129 | "mimetype": null, | ||||
2130 | "mimetype_inner": null, | ||||
2131 | "name": | ||||
2132 | cessed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_tpr_00010.tpr", | ||||
2133 | "owner_org": "mduq", | ||||
2134 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
2135 | "position": 83, | ||||
2136 | "resource_type": "tpr", | ||||
2137 | "run": 10, | ||||
2138 | "size": 7427940, | ||||
2139 | "state": "active", | ||||
2140 | "url": | ||||
2141 | cessed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_tpr_00010.tpr", | ||||
2142 | "url_type": null | ||||
2143 | }, | ||||
2144 | { | ||||
2145 | "cache_last_updated": null, | ||||
2146 | "cache_url": null, | ||||
2147 | "created": "2023-01-31T07:03:09.269976", | ||||
2148 | "description": null, | ||||
2149 | "format": "top", | ||||
2150 | "hash": "", | ||||
2151 | "id": "679d036c-ab31-48d7-a710-81a030efa281", | ||||
2152 | "last_modified": null, | ||||
2153 | "metadata_modified": "2023-01-31T07:03:09.232883", | ||||
2154 | "mimetype": null, | ||||
2155 | "mimetype_inner": null, | ||||
2156 | "name": | ||||
2157 | d_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_topology_00010.top", | ||||
2158 | "owner_org": "mduq", | ||||
2159 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
2160 | "position": 84, | ||||
2161 | "resource_type": "topology", | ||||
2162 | "run": 10, | ||||
2163 | "size": 3409, | ||||
2164 | "state": "active", | ||||
2165 | "url": | ||||
2166 | d_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_topology_00010.top", | ||||
2167 | "url_type": null | ||||
2168 | }, | ||||
2169 | { | ||||
2170 | "cache_last_updated": null, | ||||
2171 | "cache_url": null, | ||||
2172 | "created": "2023-01-31T07:03:09.269977", | ||||
2173 | "description": null, | ||||
2174 | "format": "gro", | ||||
2175 | "hash": "", | ||||
2176 | "id": "f5f88bd1-ea3a-4e92-8906-d83632fd7029", | ||||
2177 | "last_modified": null, | ||||
2178 | "metadata_modified": "2023-01-31T07:03:09.232990", | ||||
2179 | "mimetype": null, | ||||
2180 | "mimetype_inner": null, | ||||
2181 | "name": | ||||
2182 | ent_CBP_Irppy2acac_with-choloroform_310K_final-coordinates_00010.gro", | ||||
2183 | "owner_org": "mduq", | ||||
2184 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
2185 | "position": 85, | ||||
2186 | "resource_type": "final-coordinates", | ||||
2187 | "run": 10, | ||||
2188 | "size": 19694508, | ||||
2189 | "state": "active", | ||||
2190 | "url": | ||||
2191 | ent_CBP_Irppy2acac_with-choloroform_310K_final-coordinates_00010.gro", | ||||
2192 | "url_type": null | ||||
2193 | }, | ||||
2194 | { | ||||
2195 | "cache_last_updated": null, | ||||
2196 | "cache_url": null, | ||||
2197 | "created": "2023-01-31T07:03:09.269978", | ||||
2198 | "description": null, | ||||
2199 | "format": "gro", | ||||
2200 | "hash": "", | ||||
2201 | "id": "ac29bab5-e1bf-4029-b447-af19b8a816f2", | ||||
2202 | "last_modified": null, | ||||
2203 | "metadata_modified": "2023-01-31T07:03:09.233098", | ||||
2204 | "mimetype": null, | ||||
2205 | "mimetype_inner": null, | ||||
2206 | "name": | ||||
2207 | 6wtpercent_CBP_Irppy2acac_with-choloroform_310K_restraints_00010.gro", | ||||
2208 | "owner_org": "mduq", | ||||
2209 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
2210 | "position": 86, | ||||
2211 | "resource_type": "restraints", | ||||
2212 | "run": 10, | ||||
2213 | "size": 19694526, | ||||
2214 | "state": "active", | ||||
2215 | "url": | ||||
2216 | 6wtpercent_CBP_Irppy2acac_with-choloroform_310K_restraints_00010.gro", | ||||
2217 | "url_type": null | ||||
2218 | }, | ||||
2219 | { | ||||
2220 | "cache_last_updated": null, | ||||
2221 | "cache_url": null, | ||||
2222 | "created": "2023-01-31T07:03:09.269980", | ||||
2223 | "description": null, | ||||
2224 | "format": "mdp", | ||||
2225 | "hash": "", | ||||
2226 | "id": "97995d6b-fccd-4d05-bdfc-380168b49bca", | ||||
2227 | "last_modified": null, | ||||
2228 | "metadata_modified": "2023-01-31T07:03:09.233205", | ||||
2229 | "mimetype": null, | ||||
2230 | "mimetype_inner": null, | ||||
2231 | "name": | ||||
2232 | ed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_control_00011.mdp", | ||||
2233 | "owner_org": "mduq", | ||||
2234 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
2235 | "position": 87, | ||||
2236 | "resource_type": "control", | ||||
2237 | "run": 11, | ||||
2238 | "size": 1729, | ||||
2239 | "state": "active", | ||||
2240 | "url": | ||||
2241 | ed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_control_00011.mdp", | ||||
2242 | "url_type": null | ||||
2243 | }, | ||||
2244 | { | ||||
2245 | "cache_last_updated": null, | ||||
2246 | "cache_url": null, | ||||
2247 | "created": "2023-01-31T07:03:09.269981", | ||||
2248 | "description": null, | ||||
2249 | "format": "gro", | ||||
2250 | "hash": "", | ||||
2251 | "id": "2335d026-9899-4e7d-a167-4a45017ec8c1", | ||||
2252 | "last_modified": null, | ||||
2253 | "metadata_modified": "2023-01-31T07:03:09.233325", | ||||
2254 | "mimetype": null, | ||||
2255 | "mimetype_inner": null, | ||||
2256 | "name": | ||||
2257 | ent_CBP_Irppy2acac_with-choloroform_310K_input-coordinates_00011.gro", | ||||
2258 | "owner_org": "mduq", | ||||
2259 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
2260 | "position": 88, | ||||
2261 | "resource_type": "input-coordinates", | ||||
2262 | "run": 11, | ||||
2263 | "size": 19691767, | ||||
2264 | "state": "active", | ||||
2265 | "url": | ||||
2266 | ent_CBP_Irppy2acac_with-choloroform_310K_input-coordinates_00011.gro", | ||||
2267 | "url_type": null | ||||
2268 | }, | ||||
2269 | { | ||||
2270 | "cache_last_updated": null, | ||||
2271 | "cache_url": null, | ||||
2272 | "created": "2023-01-31T07:03:09.269982", | ||||
2273 | "description": null, | ||||
2274 | "format": "log", | ||||
2275 | "hash": "", | ||||
2276 | "id": "cf77c074-46d7-424f-a456-62215e5d6d6f", | ||||
2277 | "last_modified": null, | ||||
2278 | "metadata_modified": "2023-01-31T07:03:09.233433", | ||||
2279 | "mimetype": null, | ||||
2280 | "mimetype_inner": null, | ||||
2281 | "name": | ||||
2282 | cessed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_log_00011.log", | ||||
2283 | "owner_org": "mduq", | ||||
2284 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
2285 | "position": 89, | ||||
2286 | "resource_type": "log", | ||||
2287 | "run": 11, | ||||
2288 | "size": 36685, | ||||
2289 | "state": "active", | ||||
2290 | "url": | ||||
2291 | cessed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_log_00011.log", | ||||
2292 | "url_type": null | ||||
2293 | }, | ||||
2294 | { | ||||
2295 | "cache_last_updated": null, | ||||
2296 | "cache_url": null, | ||||
2297 | "created": "2023-01-31T07:03:09.269983", | ||||
2298 | "description": null, | ||||
2299 | "format": "edr", | ||||
2300 | "hash": "", | ||||
2301 | "id": "7c05f688-ff23-41e6-8e2d-75a729e79c35", | ||||
2302 | "last_modified": null, | ||||
2303 | "metadata_modified": "2023-01-31T07:03:09.233541", | ||||
2304 | "mimetype": null, | ||||
2305 | "mimetype_inner": null, | ||||
2306 | "name": | ||||
2307 | sed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_energy_00011.edr", | ||||
2308 | "owner_org": "mduq", | ||||
2309 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
2310 | "position": 90, | ||||
2311 | "resource_type": "energy", | ||||
2312 | "run": 11, | ||||
2313 | "size": 497280, | ||||
2314 | "state": "active", | ||||
2315 | "url": | ||||
2316 | sed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_energy_00011.edr", | ||||
2317 | "url_type": null | ||||
2318 | }, | ||||
2319 | { | ||||
2320 | "cache_last_updated": null, | ||||
2321 | "cache_url": null, | ||||
2322 | "created": "2023-01-31T07:03:09.269985", | ||||
2323 | "description": null, | ||||
2324 | "format": "tpr", | ||||
2325 | "hash": "", | ||||
2326 | "id": "f8612ba8-081d-4d11-b9b8-44c2d73adb9f", | ||||
2327 | "last_modified": null, | ||||
2328 | "metadata_modified": "2023-01-31T07:03:09.233648", | ||||
2329 | "mimetype": null, | ||||
2330 | "mimetype_inner": null, | ||||
2331 | "name": | ||||
2332 | cessed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_tpr_00011.tpr", | ||||
2333 | "owner_org": "mduq", | ||||
2334 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
2335 | "position": 91, | ||||
2336 | "resource_type": "tpr", | ||||
2337 | "run": 11, | ||||
2338 | "size": 13128888, | ||||
2339 | "state": "active", | ||||
2340 | "url": | ||||
2341 | cessed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_tpr_00011.tpr", | ||||
2342 | "url_type": null | ||||
2343 | }, | ||||
2344 | { | ||||
2345 | "cache_last_updated": null, | ||||
2346 | "cache_url": null, | ||||
2347 | "created": "2023-01-31T07:03:09.269986", | ||||
2348 | "description": null, | ||||
2349 | "format": "top", | ||||
2350 | "hash": "", | ||||
2351 | "id": "22cbfa7d-0e1b-4eac-b14e-93c021b29695", | ||||
2352 | "last_modified": null, | ||||
2353 | "metadata_modified": "2023-01-31T07:03:09.233755", | ||||
2354 | "mimetype": null, | ||||
2355 | "mimetype_inner": null, | ||||
2356 | "name": | ||||
2357 | d_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_topology_00011.top", | ||||
2358 | "owner_org": "mduq", | ||||
2359 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
2360 | "position": 92, | ||||
2361 | "resource_type": "topology", | ||||
2362 | "run": 11, | ||||
2363 | "size": 3408, | ||||
2364 | "state": "active", | ||||
2365 | "url": | ||||
2366 | d_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_topology_00011.top", | ||||
2367 | "url_type": null | ||||
2368 | }, | ||||
2369 | { | ||||
2370 | "cache_last_updated": null, | ||||
2371 | "cache_url": null, | ||||
2372 | "created": "2023-01-31T07:03:09.269987", | ||||
2373 | "description": null, | ||||
2374 | "format": "gro", | ||||
2375 | "hash": "", | ||||
2376 | "id": "f14fee6d-9b04-46b6-9d7a-7f171125b74e", | ||||
2377 | "last_modified": null, | ||||
2378 | "metadata_modified": "2023-01-31T07:03:09.233862", | ||||
2379 | "mimetype": null, | ||||
2380 | "mimetype_inner": null, | ||||
2381 | "name": | ||||
2382 | ent_CBP_Irppy2acac_with-choloroform_310K_final-coordinates_00011.gro", | ||||
2383 | "owner_org": "mduq", | ||||
2384 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
2385 | "position": 93, | ||||
2386 | "resource_type": "final-coordinates", | ||||
2387 | "run": 11, | ||||
2388 | "size": 19691748, | ||||
2389 | "state": "active", | ||||
2390 | "url": | ||||
2391 | ent_CBP_Irppy2acac_with-choloroform_310K_final-coordinates_00011.gro", | ||||
2392 | "url_type": null | ||||
2393 | }, | ||||
2394 | { | ||||
2395 | "cache_last_updated": null, | ||||
2396 | "cache_url": null, | ||||
2397 | "created": "2023-01-31T07:03:09.269988", | ||||
2398 | "description": null, | ||||
2399 | "format": "gro", | ||||
2400 | "hash": "", | ||||
2401 | "id": "dc94105d-4c39-4a14-b043-33774ad5c3a6", | ||||
2402 | "last_modified": null, | ||||
2403 | "metadata_modified": "2023-01-31T07:03:09.233968", | ||||
2404 | "mimetype": null, | ||||
2405 | "mimetype_inner": null, | ||||
2406 | "name": | ||||
2407 | 6wtpercent_CBP_Irppy2acac_with-choloroform_310K_restraints_00011.gro", | ||||
2408 | "owner_org": "mduq", | ||||
2409 | "package_id": "baee1840-1440-469f-8e50-a78795749524", | ||||
2410 | "position": 94, | ||||
2411 | "resource_type": "restraints", | ||||
2412 | "run": 11, | ||||
2413 | "size": 19691766, | ||||
2414 | "state": "active", | ||||
2415 | "url": | ||||
2416 | 6wtpercent_CBP_Irppy2acac_with-choloroform_310K_restraints_00011.gro", | ||||
2417 | "url_type": null | ||||
2418 | } | ||||
2419 | ], | ||||
48 | "state": "active", | 2420 | "state": "active", | ||
t | 49 | "tags": [], | t | 2421 | "tags": [ |
50 | "title": | 2422 | { | ||
51 | s_solution_processed_6wtpercent_cbp_irppy2acac_with-choloroform_310k", | 2423 | "display_name": "54A7", | ||
2424 | "id": "186c2258-e1ec-4d82-943e-14c6c00ec855", | ||||
2425 | "name": "54A7", | ||||
2426 | "state": "active", | ||||
2427 | "vocabulary_id": null | ||||
2428 | }, | ||||
2429 | { | ||||
2430 | "display_name": "CBP", | ||||
2431 | "id": "5fa41c5e-5a4e-41f3-9388-a76269db2c27", | ||||
2432 | "name": "CBP", | ||||
2433 | "state": "active", | ||||
2434 | "vocabulary_id": null | ||||
2435 | }, | ||||
2436 | { | ||||
2437 | "display_name": "GROMOS", | ||||
2438 | "id": "9bb1d329-8f1c-4912-b4bf-e8a60edb401b", | ||||
2439 | "name": "GROMOS", | ||||
2440 | "state": "active", | ||||
2441 | "vocabulary_id": null | ||||
2442 | }, | ||||
2443 | { | ||||
2444 | "display_name": "Irppy2acac", | ||||
2445 | "id": "7df24153-40a3-4882-9fd5-459ac9d2ac82", | ||||
2446 | "name": "Irppy2acac", | ||||
2447 | "state": "active", | ||||
2448 | "vocabulary_id": null | ||||
2449 | }, | ||||
2450 | { | ||||
2451 | "display_name": "No. atoms at least 10000", | ||||
2452 | "id": "dc8da662-312e-4520-88fc-27229dffb7d2", | ||||
2453 | "name": "No. atoms at least 10000", | ||||
2454 | "state": "active", | ||||
2455 | "vocabulary_id": null | ||||
2456 | }, | ||||
2457 | { | ||||
2458 | "display_name": "Simulation time at least 0.1 ns", | ||||
2459 | "id": "085698e0-cb5a-467e-8d75-78213f444395", | ||||
2460 | "name": "Simulation time at least 0.1 ns", | ||||
2461 | "state": "active", | ||||
2462 | "vocabulary_id": null | ||||
2463 | }, | ||||
2464 | { | ||||
2465 | "display_name": "Temperature 310-320 K", | ||||
2466 | "id": "55da9a9e-60ac-4a2a-8dde-6c37f2afb716", | ||||
2467 | "name": "Temperature 310-320 K", | ||||
2468 | "state": "active", | ||||
2469 | "vocabulary_id": null | ||||
2470 | }, | ||||
2471 | { | ||||
2472 | "display_name": "organic thin film", | ||||
2473 | "id": "7e5c6b65-047e-44e5-9222-a0fda515f341", | ||||
2474 | "name": "organic thin film", | ||||
2475 | "state": "active", | ||||
2476 | "vocabulary_id": null | ||||
2477 | }, | ||||
2478 | { | ||||
2479 | "display_name": "solution processed", | ||||
2480 | "id": "b8a8bbb7-899e-4582-bf5c-3265f324da05", | ||||
2481 | "name": "solution processed", | ||||
2482 | "state": "active", | ||||
2483 | "vocabulary_id": null | ||||
2484 | }, | ||||
2485 | { | ||||
2486 | "display_name": "solvent evaporation", | ||||
2487 | "id": "f1fca7b7-cc04-4036-a2f8-3227e6cbc5c4", | ||||
2488 | "name": "solvent evaporation", | ||||
2489 | "state": "active", | ||||
2490 | "vocabulary_id": null | ||||
2491 | }, | ||||
2492 | { | ||||
2493 | "display_name": "thermostat is Berendsen", | ||||
2494 | "id": "4fb82905-f20b-444e-9ba9-93e5d793c273", | ||||
2495 | "name": "thermostat is Berendsen", | ||||
2496 | "state": "active", | ||||
2497 | "vocabulary_id": null | ||||
2498 | } | ||||
2499 | ], | ||||
2500 | "title": "Solution Processed 5wt% Ir(ppy)2(acac):CBP organic | ||||
2501 | thinfilm", | ||||
52 | "type": "dataset", | 2502 | "type": "dataset", | ||
53 | "url": null, | 2503 | "url": null, | ||
54 | "version": null | 2504 | "version": null | ||
55 | } | 2505 | } |