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Uploaded a new file to resource solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_tpr_00005.tpr in Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
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Uploaded a new file to resource solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_tpr_00007.tpr in Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
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Uploaded a new file to resource solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_tpr_00008.tpr in Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
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Uploaded a new file to resource solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_tpr_00001.tpr in Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
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Uploaded a new file to resource solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_tpr_00006.tpr in Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
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Uploaded a new file to resource solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_tpr_00009.tpr in Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
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Uploaded a new file to resource solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_tpr_00002.tpr in Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
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Uploaded a new file to resource solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_tpr_00004.tpr in Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
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Uploaded a new file to resource solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_tpr_00010.tpr in Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
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Uploaded a new file to resource solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_tpr_00011.tpr in Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
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Uploaded a new file to resource solution_processed_6wtpercent_CBP_Irppy2acac_with-choloroform_310K_tpr_00003.tpr in Solution Processed 5wt% Ir(ppy)2(acac):CBP organic thinfilm
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| 15 | "name": | 15 | "name": | ||
| 16 | s_solution_processed_6wtpercent_cbp_irppy2acac_with-choloroform_310k", | 16 | s_solution_processed_6wtpercent_cbp_irppy2acac_with-choloroform_310k", | ||
| 17 | "notes": "A simulation of a 5wt% Ir(ppy)2(acac):CBP organic thinfilm | 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 | 18 | that is being formed by solvent evaporation. The solvent used is | ||
| 19 | chloroform. All 11 files are from different stages of the evaporation | 19 | chloroform. All 11 files are from different stages of the evaporation | ||
| 20 | from the start of the simulation to the dried film.", | 20 | from the start of the simulation to the dried film.", | ||
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| 22 | "num_tags": 11, | 22 | "num_tags": 11, | ||
| 23 | "organization": { | 23 | "organization": { | ||
| 24 | "approval_status": "approved", | 24 | "approval_status": "approved", | ||
| 25 | "created": "2018-08-22T23:34:31.662568", | 25 | "created": "2018-08-22T23:34:31.662568", | ||
| 26 | "description": "The group focuses on understanding and predicting | 26 | "description": "The group focuses on understanding and predicting | ||
| 27 | the macroscopic (experimentally observable) properties of biomolecular | 27 | the macroscopic (experimentally observable) properties of biomolecular | ||
| 28 | systems such as proteins, nucleic acids and lipid aggregates, in terms | 28 | systems such as proteins, nucleic acids and lipid aggregates, in terms | ||
| 29 | of the interactions between atoms. In particular, our work | 29 | of the interactions between atoms. In particular, our work | ||
| 30 | concentrates on the development of tools (i.e. simulation software, | 30 | concentrates on the development of tools (i.e. simulation software, | ||
| 31 | atomic force fields, theoretical models and experimental techniques) | 31 | atomic force fields, theoretical models and experimental techniques) | ||
| 32 | 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 | ||
| 33 | of interactions and dynamic processes within biomolecular systems. | 33 | of interactions and dynamic processes within biomolecular systems. | ||
| 34 | Specific areas of interest include structure prediction, protein and | 34 | Specific areas of interest include structure prediction, protein and | ||
| 35 | peptide folding, the self-assembly of protein/lipid complexes and the | 35 | peptide folding, the self-assembly of protein/lipid complexes and the | ||
| 36 | calculation of thermodynamic properties such as ligand binding | 36 | calculation of thermodynamic properties such as ligand binding | ||
| 37 | affinities.\r\n\r\n(Image created by Dr D. Poger)", | 37 | affinities.\r\n\r\n(Image created by Dr D. Poger)", | ||
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