Changes
On 12:02:29 +1000 do 6 de abril de 2021,
uploader:
-
Removed the following fields from Hendra virus fusion protein low pH 1/3
-
temperature
-
runtime
-
initial_temperature
-
-
Changed value of field
pressure
to1.0
in Hendra virus fusion protein low pH 1/3 -
Changed value of field
num_atoms
to411975
in Hendra virus fusion protein low pH 1/3 -
Changed value of field
simulation_time
to50.0
in Hendra virus fusion protein low pH 1/3
| f | 1 | { | f | 1 | { |
| 2 | "author": "", | 2 | "author": "", | ||
| 3 | "author_email": "", | 3 | "author_email": "", | ||
| 4 | "creator_user_id": "26e9b37a-a639-46f2-9a41-f9295eef2db8", | 4 | "creator_user_id": "26e9b37a-a639-46f2-9a41-f9295eef2db8", | ||
| 5 | "extras": [ | 5 | "extras": [ | ||
| 6 | { | 6 | { | ||
| n | 7 | "key": "initial_temperature", | n | ||
| 8 | "value": "" | ||||
| 9 | }, | ||||
| 10 | { | ||||
| 11 | "key": "num_atoms", | 7 | "key": "num_atoms", | ||
| n | 12 | "value": "" | n | 8 | "value": "411975" |
| 13 | }, | 9 | }, | ||
| 14 | { | 10 | { | ||
| 15 | "key": "pressure", | 11 | "key": "pressure", | ||
| n | 16 | "value": "" | n | 12 | "value": "1.0" |
| 17 | }, | ||||
| 18 | { | ||||
| 19 | "key": "runtime", | ||||
| 20 | "value": "" | ||||
| 21 | }, | 13 | }, | ||
| 22 | { | 14 | { | ||
| 23 | "key": "simulation_time", | 15 | "key": "simulation_time", | ||
| t | 24 | "value": "" | t | 16 | "value": "50.0" |
| 25 | }, | ||||
| 26 | { | ||||
| 27 | "key": "temperature", | ||||
| 28 | "value": "" | ||||
| 29 | } | 17 | } | ||
| 30 | ], | 18 | ], | ||
| 31 | "groups": [], | 19 | "groups": [], | ||
| 32 | "id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | 20 | "id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | ||
| 33 | "isopen": true, | 21 | "isopen": true, | ||
| 34 | "license_id": "cc-by", | 22 | "license_id": "cc-by", | ||
| 35 | "license_title": "Creative Commons Attribution", | 23 | "license_title": "Creative Commons Attribution", | ||
| 36 | "license_url": "http://www.opendefinition.org/licenses/cc-by", | 24 | "license_url": "http://www.opendefinition.org/licenses/cc-by", | ||
| 37 | "maintainer": "", | 25 | "maintainer": "", | ||
| 38 | "maintainer_email": "", | 26 | "maintainer_email": "", | ||
| 39 | "metadata_created": "2021-03-04T06:17:15.933128", | 27 | "metadata_created": "2021-03-04T06:17:15.933128", | ||
| 40 | "metadata_modified": "2021-04-06T02:02:17.057669", | 28 | "metadata_modified": "2021-04-06T02:02:17.057669", | ||
| 41 | "name": "hendra_gromacs_lowph_sim1", | 29 | "name": "hendra_gromacs_lowph_sim1", | ||
| 42 | "notes": "A simulation of the Hendra virus fusion protein [pdbid | 30 | "notes": "A simulation of the Hendra virus fusion protein [pdbid | ||
| 43 | 5ejb] in water with complete amino acid protonation as to mimic pH 3 | 31 | 5ejb] in water with complete amino acid protonation as to mimic pH 3 | ||
| 44 | in the late endosome/ lysosome.", | 32 | in the late endosome/ lysosome.", | ||
| 45 | "num_resources": 32, | 33 | "num_resources": 32, | ||
| 46 | "num_tags": 14, | 34 | "num_tags": 14, | ||
| 47 | "organization": { | 35 | "organization": { | ||
| 48 | "approval_status": "approved", | 36 | "approval_status": "approved", | ||
| 49 | "created": "2018-08-22T23:34:31.662568", | 37 | "created": "2018-08-22T23:34:31.662568", | ||
| 50 | "description": "", | 38 | "description": "", | ||
| 51 | "id": "13d88f1a-558b-460e-ad12-400abee89835", | 39 | "id": "13d88f1a-558b-460e-ad12-400abee89835", | ||
| 52 | "image_url": "", | 40 | "image_url": "", | ||
| 53 | "is_organization": true, | 41 | "is_organization": true, | ||
| 54 | "name": "mduq", | 42 | "name": "mduq", | ||
| 55 | "state": "active", | 43 | "state": "active", | ||
| 56 | "title": "Molecular Dynamics Group UQ", | 44 | "title": "Molecular Dynamics Group UQ", | ||
| 57 | "type": "organization" | 45 | "type": "organization" | ||
| 58 | }, | 46 | }, | ||
| 59 | "owner_org": "13d88f1a-558b-460e-ad12-400abee89835", | 47 | "owner_org": "13d88f1a-558b-460e-ad12-400abee89835", | ||
| 60 | "private": false, | 48 | "private": false, | ||
| 61 | "relationships_as_object": [], | 49 | "relationships_as_object": [], | ||
| 62 | "relationships_as_subject": [], | 50 | "relationships_as_subject": [], | ||
| 63 | "resources": [ | 51 | "resources": [ | ||
| 64 | { | 52 | { | ||
| 65 | "cache_last_updated": null, | 53 | "cache_last_updated": null, | ||
| 66 | "cache_url": null, | 54 | "cache_url": null, | ||
| 67 | "created": "2021-04-06T01:56:20.910961", | 55 | "created": "2021-04-06T01:56:20.910961", | ||
| 68 | "description": "", | 56 | "description": "", | ||
| 69 | "format": "mdp", | 57 | "format": "mdp", | ||
| 70 | "hash": "", | 58 | "hash": "", | ||
| 71 | "id": "187dd03d-fd94-45df-8ba8-141ac0dfc2a7", | 59 | "id": "187dd03d-fd94-45df-8ba8-141ac0dfc2a7", | ||
| 72 | "last_modified": null, | 60 | "last_modified": null, | ||
| 73 | "mimetype": null, | 61 | "mimetype": null, | ||
| 74 | "mimetype_inner": null, | 62 | "mimetype_inner": null, | ||
| 75 | "name": "Hendra_GROMACS_LowpH_sim1_control_00001.mdp", | 63 | "name": "Hendra_GROMACS_LowpH_sim1_control_00001.mdp", | ||
| 76 | "owner_org": "mduq", | 64 | "owner_org": "mduq", | ||
| 77 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | 65 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | ||
| 78 | "position": 0, | 66 | "position": 0, | ||
| 79 | "resource_type": "control", | 67 | "resource_type": "control", | ||
| 80 | "run": 1, | 68 | "run": 1, | ||
| 81 | "size": 11829, | 69 | "size": 11829, | ||
| 82 | "state": "active", | 70 | "state": "active", | ||
| 83 | "url": | 71 | "url": | ||
| 84 | U3CXjmQbw01_JYelMIMp8Y7w/Hendra_GROMACS_LowpH_sim1_control_00001.mdp", | 72 | U3CXjmQbw01_JYelMIMp8Y7w/Hendra_GROMACS_LowpH_sim1_control_00001.mdp", | ||
| 85 | "url_type": null | 73 | "url_type": null | ||
| 86 | }, | 74 | }, | ||
| 87 | { | 75 | { | ||
| 88 | "cache_last_updated": null, | 76 | "cache_last_updated": null, | ||
| 89 | "cache_url": null, | 77 | "cache_url": null, | ||
| 90 | "created": "2021-04-06T01:56:20.910966", | 78 | "created": "2021-04-06T01:56:20.910966", | ||
| 91 | "description": "", | 79 | "description": "", | ||
| 92 | "format": "itp", | 80 | "format": "itp", | ||
| 93 | "hash": "", | 81 | "hash": "", | ||
| 94 | "id": "b84e01cd-2805-4f18-a03d-2e1daba43c11", | 82 | "id": "b84e01cd-2805-4f18-a03d-2e1daba43c11", | ||
| 95 | "last_modified": null, | 83 | "last_modified": null, | ||
| 96 | "mimetype": null, | 84 | "mimetype": null, | ||
| 97 | "mimetype_inner": null, | 85 | "mimetype_inner": null, | ||
| 98 | "name": "hendra_low_ph_monomer_1_helix_res.itp", | 86 | "name": "hendra_low_ph_monomer_1_helix_res.itp", | ||
| 99 | "owner_org": "mduq", | 87 | "owner_org": "mduq", | ||
| 100 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | 88 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | ||
| 101 | "position": 1, | 89 | "position": 1, | ||
| 102 | "resource_type": "itp-files", | 90 | "resource_type": "itp-files", | ||
| 103 | "run": 1, | 91 | "run": 1, | ||
| 104 | "size": 20640, | 92 | "size": 20640, | ||
| 105 | "state": "active", | 93 | "state": "active", | ||
| 106 | "url": | 94 | "url": | ||
| 107 | PSL2k7aVeP2FM4pzA13Uestpe3Ubg8/hendra_low_ph_monomer_1_helix_res.itp", | 95 | PSL2k7aVeP2FM4pzA13Uestpe3Ubg8/hendra_low_ph_monomer_1_helix_res.itp", | ||
| 108 | "url_type": null | 96 | "url_type": null | ||
| 109 | }, | 97 | }, | ||
| 110 | { | 98 | { | ||
| 111 | "cache_last_updated": null, | 99 | "cache_last_updated": null, | ||
| 112 | "cache_url": null, | 100 | "cache_url": null, | ||
| 113 | "created": "2021-04-06T01:56:20.910968", | 101 | "created": "2021-04-06T01:56:20.910968", | ||
| 114 | "description": "", | 102 | "description": "", | ||
| 115 | "format": "itp", | 103 | "format": "itp", | ||
| 116 | "hash": "", | 104 | "hash": "", | ||
| 117 | "id": "8710fa99-0694-45a7-ae09-9784f4f2055b", | 105 | "id": "8710fa99-0694-45a7-ae09-9784f4f2055b", | ||
| 118 | "last_modified": null, | 106 | "last_modified": null, | ||
| 119 | "mimetype": null, | 107 | "mimetype": null, | ||
| 120 | "mimetype_inner": null, | 108 | "mimetype_inner": null, | ||
| 121 | "name": "hendra_low_ph_monomer_2_pr.itp", | 109 | "name": "hendra_low_ph_monomer_2_pr.itp", | ||
| 122 | "owner_org": "mduq", | 110 | "owner_org": "mduq", | ||
| 123 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | 111 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | ||
| 124 | "position": 2, | 112 | "position": 2, | ||
| 125 | "resource_type": "itp-files", | 113 | "resource_type": "itp-files", | ||
| 126 | "run": 1, | 114 | "run": 1, | ||
| 127 | "size": 87228, | 115 | "size": 87228, | ||
| 128 | "state": "active", | 116 | "state": "active", | ||
| 129 | "url": | 117 | "url": | ||
| 130 | LJhw8Q8oZu20I6lf9D6aU6fW7-uh7pCbI-ZTs/hendra_low_ph_monomer_2_pr.itp", | 118 | LJhw8Q8oZu20I6lf9D6aU6fW7-uh7pCbI-ZTs/hendra_low_ph_monomer_2_pr.itp", | ||
| 131 | "url_type": null | 119 | "url_type": null | ||
| 132 | }, | 120 | }, | ||
| 133 | { | 121 | { | ||
| 134 | "cache_last_updated": null, | 122 | "cache_last_updated": null, | ||
| 135 | "cache_url": null, | 123 | "cache_url": null, | ||
| 136 | "created": "2021-04-06T01:56:20.910970", | 124 | "created": "2021-04-06T01:56:20.910970", | ||
| 137 | "description": "", | 125 | "description": "", | ||
| 138 | "format": "itp", | 126 | "format": "itp", | ||
| 139 | "hash": "", | 127 | "hash": "", | ||
| 140 | "id": "6d2344a5-c0d6-4d65-a1e8-d96f3c9b896e", | 128 | "id": "6d2344a5-c0d6-4d65-a1e8-d96f3c9b896e", | ||
| 141 | "last_modified": null, | 129 | "last_modified": null, | ||
| 142 | "mimetype": null, | 130 | "mimetype": null, | ||
| 143 | "mimetype_inner": null, | 131 | "mimetype_inner": null, | ||
| 144 | "name": "hendra_low_ph_monomer_1_pr.itp", | 132 | "name": "hendra_low_ph_monomer_1_pr.itp", | ||
| 145 | "owner_org": "mduq", | 133 | "owner_org": "mduq", | ||
| 146 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | 134 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | ||
| 147 | "position": 3, | 135 | "position": 3, | ||
| 148 | "resource_type": "itp-files", | 136 | "resource_type": "itp-files", | ||
| 149 | "run": 1, | 137 | "run": 1, | ||
| 150 | "size": 20640, | 138 | "size": 20640, | ||
| 151 | "state": "active", | 139 | "state": "active", | ||
| 152 | "url": | 140 | "url": | ||
| 153 | J59Dk8HBeneHriatZA9IwcjQb4n2DPz3dSmBY/hendra_low_ph_monomer_1_pr.itp", | 141 | J59Dk8HBeneHriatZA9IwcjQb4n2DPz3dSmBY/hendra_low_ph_monomer_1_pr.itp", | ||
| 154 | "url_type": null | 142 | "url_type": null | ||
| 155 | }, | 143 | }, | ||
| 156 | { | 144 | { | ||
| 157 | "cache_last_updated": null, | 145 | "cache_last_updated": null, | ||
| 158 | "cache_url": null, | 146 | "cache_url": null, | ||
| 159 | "created": "2021-04-06T01:56:20.910972", | 147 | "created": "2021-04-06T01:56:20.910972", | ||
| 160 | "description": "", | 148 | "description": "", | ||
| 161 | "format": "itp", | 149 | "format": "itp", | ||
| 162 | "hash": "", | 150 | "hash": "", | ||
| 163 | "id": "d0ef5368-aa46-4d62-88b6-edfef90ce9e5", | 151 | "id": "d0ef5368-aa46-4d62-88b6-edfef90ce9e5", | ||
| 164 | "last_modified": null, | 152 | "last_modified": null, | ||
| 165 | "mimetype": null, | 153 | "mimetype": null, | ||
| 166 | "mimetype_inner": null, | 154 | "mimetype_inner": null, | ||
| 167 | "name": "hendra_low_ph_monomer_2_helix_res.itp", | 155 | "name": "hendra_low_ph_monomer_2_helix_res.itp", | ||
| 168 | "owner_org": "mduq", | 156 | "owner_org": "mduq", | ||
| 169 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | 157 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | ||
| 170 | "position": 4, | 158 | "position": 4, | ||
| 171 | "resource_type": "itp-files", | 159 | "resource_type": "itp-files", | ||
| 172 | "run": 1, | 160 | "run": 1, | ||
| 173 | "size": 87228, | 161 | "size": 87228, | ||
| 174 | "state": "active", | 162 | "state": "active", | ||
| 175 | "url": | 163 | "url": | ||
| 176 | TtcBYO53u9qmAEIxKO6GnPrcgjnx0o/hendra_low_ph_monomer_2_helix_res.itp", | 164 | TtcBYO53u9qmAEIxKO6GnPrcgjnx0o/hendra_low_ph_monomer_2_helix_res.itp", | ||
| 177 | "url_type": null | 165 | "url_type": null | ||
| 178 | }, | 166 | }, | ||
| 179 | { | 167 | { | ||
| 180 | "cache_last_updated": null, | 168 | "cache_last_updated": null, | ||
| 181 | "cache_url": null, | 169 | "cache_url": null, | ||
| 182 | "created": "2021-04-06T01:56:20.910974", | 170 | "created": "2021-04-06T01:56:20.910974", | ||
| 183 | "description": "", | 171 | "description": "", | ||
| 184 | "format": "itp", | 172 | "format": "itp", | ||
| 185 | "hash": "", | 173 | "hash": "", | ||
| 186 | "id": "4b7213cd-9e80-4199-a105-957e87d2c671", | 174 | "id": "4b7213cd-9e80-4199-a105-957e87d2c671", | ||
| 187 | "last_modified": null, | 175 | "last_modified": null, | ||
| 188 | "mimetype": null, | 176 | "mimetype": null, | ||
| 189 | "mimetype_inner": null, | 177 | "mimetype_inner": null, | ||
| 190 | "name": "hendra_low_ph_monomer_1.itp", | 178 | "name": "hendra_low_ph_monomer_1.itp", | ||
| 191 | "owner_org": "mduq", | 179 | "owner_org": "mduq", | ||
| 192 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | 180 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | ||
| 193 | "position": 5, | 181 | "position": 5, | ||
| 194 | "resource_type": "itp-files", | 182 | "resource_type": "itp-files", | ||
| 195 | "run": 1, | 183 | "run": 1, | ||
| 196 | "size": 205566, | 184 | "size": 205566, | ||
| 197 | "state": "active", | 185 | "state": "active", | ||
| 198 | "url": | 186 | "url": | ||
| 199 | -4_E8QtKbKR0edNyYouu2HAvvU_0G3StiUqIm7PE/hendra_low_ph_monomer_1.itp", | 187 | -4_E8QtKbKR0edNyYouu2HAvvU_0G3StiUqIm7PE/hendra_low_ph_monomer_1.itp", | ||
| 200 | "url_type": null | 188 | "url_type": null | ||
| 201 | }, | 189 | }, | ||
| 202 | { | 190 | { | ||
| 203 | "cache_last_updated": null, | 191 | "cache_last_updated": null, | ||
| 204 | "cache_url": null, | 192 | "cache_url": null, | ||
| 205 | "created": "2021-04-06T01:56:20.910976", | 193 | "created": "2021-04-06T01:56:20.910976", | ||
| 206 | "description": "", | 194 | "description": "", | ||
| 207 | "format": "xtc", | 195 | "format": "xtc", | ||
| 208 | "hash": "", | 196 | "hash": "", | ||
| 209 | "id": "d68b4c9a-e3d6-4138-bdaa-22b79480989f", | 197 | "id": "d68b4c9a-e3d6-4138-bdaa-22b79480989f", | ||
| 210 | "last_modified": null, | 198 | "last_modified": null, | ||
| 211 | "mimetype": null, | 199 | "mimetype": null, | ||
| 212 | "mimetype_inner": null, | 200 | "mimetype_inner": null, | ||
| 213 | "name": "Hendra_GROMACS_LowpH_sim1_trajectory_00001.xtc", | 201 | "name": "Hendra_GROMACS_LowpH_sim1_trajectory_00001.xtc", | ||
| 214 | "owner_org": "mduq", | 202 | "owner_org": "mduq", | ||
| 215 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | 203 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | ||
| 216 | "position": 6, | 204 | "position": 6, | ||
| 217 | "resource_type": "trajectory", | 205 | "resource_type": "trajectory", | ||
| 218 | "run": 1, | 206 | "run": 1, | ||
| 219 | "size": 40921468, | 207 | "size": 40921468, | ||
| 220 | "state": "active", | 208 | "state": "active", | ||
| 221 | "url": | 209 | "url": | ||
| 222 | g6IOfe9sIIO3kM9FcydDI/Hendra_GROMACS_LowpH_sim1_trajectory_00001.xtc", | 210 | g6IOfe9sIIO3kM9FcydDI/Hendra_GROMACS_LowpH_sim1_trajectory_00001.xtc", | ||
| 223 | "url_type": null | 211 | "url_type": null | ||
| 224 | }, | 212 | }, | ||
| 225 | { | 213 | { | ||
| 226 | "cache_last_updated": null, | 214 | "cache_last_updated": null, | ||
| 227 | "cache_url": null, | 215 | "cache_url": null, | ||
| 228 | "created": "2021-04-06T01:56:20.910978", | 216 | "created": "2021-04-06T01:56:20.910978", | ||
| 229 | "description": "", | 217 | "description": "", | ||
| 230 | "format": "tpr", | 218 | "format": "tpr", | ||
| 231 | "hash": "", | 219 | "hash": "", | ||
| 232 | "id": "18ee313c-4e3c-4eea-a69d-aae02f0a7055", | 220 | "id": "18ee313c-4e3c-4eea-a69d-aae02f0a7055", | ||
| 233 | "last_modified": null, | 221 | "last_modified": null, | ||
| 234 | "mimetype": null, | 222 | "mimetype": null, | ||
| 235 | "mimetype_inner": null, | 223 | "mimetype_inner": null, | ||
| 236 | "name": "Hendra_GROMACS_LowpH_sim1_input-coordinates_00001.tpr", | 224 | "name": "Hendra_GROMACS_LowpH_sim1_input-coordinates_00001.tpr", | ||
| 237 | "owner_org": "mduq", | 225 | "owner_org": "mduq", | ||
| 238 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | 226 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | ||
| 239 | "position": 7, | 227 | "position": 7, | ||
| 240 | "resource_type": "input-coordinates", | 228 | "resource_type": "input-coordinates", | ||
| 241 | "run": 1, | 229 | "run": 1, | ||
| 242 | "size": 23065052, | 230 | "size": 23065052, | ||
| 243 | "state": "active", | 231 | "state": "active", | ||
| 244 | "url": | 232 | "url": | ||
| 245 | t3D8mFjpNvIKEs/Hendra_GROMACS_LowpH_sim1_input-coordinates_00001.tpr", | 233 | t3D8mFjpNvIKEs/Hendra_GROMACS_LowpH_sim1_input-coordinates_00001.tpr", | ||
| 246 | "url_type": null | 234 | "url_type": null | ||
| 247 | }, | 235 | }, | ||
| 248 | { | 236 | { | ||
| 249 | "cache_last_updated": null, | 237 | "cache_last_updated": null, | ||
| 250 | "cache_url": null, | 238 | "cache_url": null, | ||
| 251 | "created": "2021-04-06T01:56:20.910979", | 239 | "created": "2021-04-06T01:56:20.910979", | ||
| 252 | "description": "", | 240 | "description": "", | ||
| 253 | "format": "log", | 241 | "format": "log", | ||
| 254 | "hash": "", | 242 | "hash": "", | ||
| 255 | "id": "d99b9512-e227-41a5-a44b-974c565be4fd", | 243 | "id": "d99b9512-e227-41a5-a44b-974c565be4fd", | ||
| 256 | "last_modified": null, | 244 | "last_modified": null, | ||
| 257 | "mimetype": null, | 245 | "mimetype": null, | ||
| 258 | "mimetype_inner": null, | 246 | "mimetype_inner": null, | ||
| 259 | "name": "Hendra_GROMACS_LowpH_sim1_log_00001.log", | 247 | "name": "Hendra_GROMACS_LowpH_sim1_log_00001.log", | ||
| 260 | "owner_org": "mduq", | 248 | "owner_org": "mduq", | ||
| 261 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | 249 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | ||
| 262 | "position": 8, | 250 | "position": 8, | ||
| 263 | "resource_type": "log", | 251 | "resource_type": "log", | ||
| 264 | "run": 1, | 252 | "run": 1, | ||
| 265 | "size": 58185, | 253 | "size": 58185, | ||
| 266 | "state": "active", | 254 | "state": "active", | ||
| 267 | "url": | 255 | "url": | ||
| 268 | cCQc5JAhE68Gg81SB83woYGn6LOk/Hendra_GROMACS_LowpH_sim1_log_00001.log", | 256 | cCQc5JAhE68Gg81SB83woYGn6LOk/Hendra_GROMACS_LowpH_sim1_log_00001.log", | ||
| 269 | "url_type": null | 257 | "url_type": null | ||
| 270 | }, | 258 | }, | ||
| 271 | { | 259 | { | ||
| 272 | "cache_last_updated": null, | 260 | "cache_last_updated": null, | ||
| 273 | "cache_url": null, | 261 | "cache_url": null, | ||
| 274 | "created": "2021-04-06T01:56:20.910981", | 262 | "created": "2021-04-06T01:56:20.910981", | ||
| 275 | "description": "", | 263 | "description": "", | ||
| 276 | "format": "edr", | 264 | "format": "edr", | ||
| 277 | "hash": "", | 265 | "hash": "", | ||
| 278 | "id": "50fbc9d4-a99e-44cc-9721-ec8f7e1e93b9", | 266 | "id": "50fbc9d4-a99e-44cc-9721-ec8f7e1e93b9", | ||
| 279 | "last_modified": null, | 267 | "last_modified": null, | ||
| 280 | "mimetype": null, | 268 | "mimetype": null, | ||
| 281 | "mimetype_inner": null, | 269 | "mimetype_inner": null, | ||
| 282 | "name": "Hendra_GROMACS_LowpH_sim1_energy_00001.edr", | 270 | "name": "Hendra_GROMACS_LowpH_sim1_energy_00001.edr", | ||
| 283 | "owner_org": "mduq", | 271 | "owner_org": "mduq", | ||
| 284 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | 272 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | ||
| 285 | "position": 9, | 273 | "position": 9, | ||
| 286 | "resource_type": "energy", | 274 | "resource_type": "energy", | ||
| 287 | "run": 1, | 275 | "run": 1, | ||
| 288 | "size": 12416, | 276 | "size": 12416, | ||
| 289 | "state": "active", | 277 | "state": "active", | ||
| 290 | "url": | 278 | "url": | ||
| 291 | vyiRXmKAL3bmpZ6n3S_p7JEzg/Hendra_GROMACS_LowpH_sim1_energy_00001.edr", | 279 | vyiRXmKAL3bmpZ6n3S_p7JEzg/Hendra_GROMACS_LowpH_sim1_energy_00001.edr", | ||
| 292 | "url_type": null | 280 | "url_type": null | ||
| 293 | }, | 281 | }, | ||
| 294 | { | 282 | { | ||
| 295 | "cache_last_updated": null, | 283 | "cache_last_updated": null, | ||
| 296 | "cache_url": null, | 284 | "cache_url": null, | ||
| 297 | "created": "2021-04-06T01:56:20.910983", | 285 | "created": "2021-04-06T01:56:20.910983", | ||
| 298 | "description": "", | 286 | "description": "", | ||
| 299 | "format": "top", | 287 | "format": "top", | ||
| 300 | "hash": "", | 288 | "hash": "", | ||
| 301 | "id": "a5199b2e-7c5e-469f-a0e2-51a81318e2e2", | 289 | "id": "a5199b2e-7c5e-469f-a0e2-51a81318e2e2", | ||
| 302 | "last_modified": null, | 290 | "last_modified": null, | ||
| 303 | "mimetype": null, | 291 | "mimetype": null, | ||
| 304 | "mimetype_inner": null, | 292 | "mimetype_inner": null, | ||
| 305 | "name": "hendra_low_ph_trimer.top", | 293 | "name": "hendra_low_ph_trimer.top", | ||
| 306 | "owner_org": "mduq", | 294 | "owner_org": "mduq", | ||
| 307 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | 295 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | ||
| 308 | "position": 10, | 296 | "position": 10, | ||
| 309 | "resource_type": "topology", | 297 | "resource_type": "topology", | ||
| 310 | "run": 1, | 298 | "run": 1, | ||
| 311 | "size": 1468, | 299 | "size": 1468, | ||
| 312 | "state": "active", | 300 | "state": "active", | ||
| 313 | "url": | 301 | "url": | ||
| 314 | AnY3odn2E8R0Tjv0sx3BOCrgcmipKDfjY4ejeitKxX0/hendra_low_ph_trimer.top", | 302 | AnY3odn2E8R0Tjv0sx3BOCrgcmipKDfjY4ejeitKxX0/hendra_low_ph_trimer.top", | ||
| 315 | "url_type": null | 303 | "url_type": null | ||
| 316 | }, | 304 | }, | ||
| 317 | { | 305 | { | ||
| 318 | "cache_last_updated": null, | 306 | "cache_last_updated": null, | ||
| 319 | "cache_url": null, | 307 | "cache_url": null, | ||
| 320 | "created": "2021-04-06T01:56:20.910985", | 308 | "created": "2021-04-06T01:56:20.910985", | ||
| 321 | "description": "", | 309 | "description": "", | ||
| 322 | "format": "gro", | 310 | "format": "gro", | ||
| 323 | "hash": "", | 311 | "hash": "", | ||
| 324 | "id": "ecea6757-4e0f-48bd-8120-ee09f81e889c", | 312 | "id": "ecea6757-4e0f-48bd-8120-ee09f81e889c", | ||
| 325 | "last_modified": null, | 313 | "last_modified": null, | ||
| 326 | "mimetype": null, | 314 | "mimetype": null, | ||
| 327 | "mimetype_inner": null, | 315 | "mimetype_inner": null, | ||
| 328 | "name": "Hendra_GROMACS_LowpH_sim1_final-coordinates_00001.gro", | 316 | "name": "Hendra_GROMACS_LowpH_sim1_final-coordinates_00001.gro", | ||
| 329 | "owner_org": "mduq", | 317 | "owner_org": "mduq", | ||
| 330 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | 318 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | ||
| 331 | "position": 11, | 319 | "position": 11, | ||
| 332 | "resource_type": "final-coordinates", | 320 | "resource_type": "final-coordinates", | ||
| 333 | "run": 1, | 321 | "run": 1, | ||
| 334 | "size": 28599657, | 322 | "size": 28599657, | ||
| 335 | "state": "active", | 323 | "state": "active", | ||
| 336 | "url": | 324 | "url": | ||
| 337 | P0LPdQar6yfRAQ/Hendra_GROMACS_LowpH_sim1_final-coordinates_00001.gro", | 325 | P0LPdQar6yfRAQ/Hendra_GROMACS_LowpH_sim1_final-coordinates_00001.gro", | ||
| 338 | "url_type": null | 326 | "url_type": null | ||
| 339 | }, | 327 | }, | ||
| 340 | { | 328 | { | ||
| 341 | "cache_last_updated": null, | 329 | "cache_last_updated": null, | ||
| 342 | "cache_url": null, | 330 | "cache_url": null, | ||
| 343 | "created": "2021-04-06T01:58:38.163975", | 331 | "created": "2021-04-06T01:58:38.163975", | ||
| 344 | "description": "", | 332 | "description": "", | ||
| 345 | "format": "gro", | 333 | "format": "gro", | ||
| 346 | "hash": "", | 334 | "hash": "", | ||
| 347 | "id": "020d8526-b297-4e4e-9371-b6cc31bdea01", | 335 | "id": "020d8526-b297-4e4e-9371-b6cc31bdea01", | ||
| 348 | "last_modified": null, | 336 | "last_modified": null, | ||
| 349 | "mimetype": null, | 337 | "mimetype": null, | ||
| 350 | "mimetype_inner": null, | 338 | "mimetype_inner": null, | ||
| 351 | "name": "Hendra_GROMACS_LowpH_sim1_initial_coordinates.gro", | 339 | "name": "Hendra_GROMACS_LowpH_sim1_initial_coordinates.gro", | ||
| 352 | "owner_org": "mduq", | 340 | "owner_org": "mduq", | ||
| 353 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | 341 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | ||
| 354 | "position": 12, | 342 | "position": 12, | ||
| 355 | "resource_type": "reference-structure", | 343 | "resource_type": "reference-structure", | ||
| 356 | "run": 1, | 344 | "run": 1, | ||
| 357 | "size": 28599657, | 345 | "size": 28599657, | ||
| 358 | "state": "active", | 346 | "state": "active", | ||
| 359 | "url": | 347 | "url": | ||
| 360 | tEr2CTR1qcLch0fIWI/Hendra_GROMACS_LowpH_sim1_initial_coordinates.gro", | 348 | tEr2CTR1qcLch0fIWI/Hendra_GROMACS_LowpH_sim1_initial_coordinates.gro", | ||
| 361 | "url_type": null | 349 | "url_type": null | ||
| 362 | }, | 350 | }, | ||
| 363 | { | 351 | { | ||
| 364 | "cache_last_updated": null, | 352 | "cache_last_updated": null, | ||
| 365 | "cache_url": null, | 353 | "cache_url": null, | ||
| 366 | "created": "2021-04-06T01:56:20.910988", | 354 | "created": "2021-04-06T01:56:20.910988", | ||
| 367 | "description": "", | 355 | "description": "", | ||
| 368 | "format": "mdp", | 356 | "format": "mdp", | ||
| 369 | "hash": "", | 357 | "hash": "", | ||
| 370 | "id": "10d87a63-0070-44b5-aafe-67179838dbe8", | 358 | "id": "10d87a63-0070-44b5-aafe-67179838dbe8", | ||
| 371 | "last_modified": null, | 359 | "last_modified": null, | ||
| 372 | "mimetype": null, | 360 | "mimetype": null, | ||
| 373 | "mimetype_inner": null, | 361 | "mimetype_inner": null, | ||
| 374 | "name": "Hendra_GROMACS_LowpH_sim1_control_00002.mdp", | 362 | "name": "Hendra_GROMACS_LowpH_sim1_control_00002.mdp", | ||
| 375 | "owner_org": "mduq", | 363 | "owner_org": "mduq", | ||
| 376 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | 364 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | ||
| 377 | "position": 13, | 365 | "position": 13, | ||
| 378 | "resource_type": "control", | 366 | "resource_type": "control", | ||
| 379 | "run": 2, | 367 | "run": 2, | ||
| 380 | "size": 11833, | 368 | "size": 11833, | ||
| 381 | "state": "active", | 369 | "state": "active", | ||
| 382 | "url": | 370 | "url": | ||
| 383 | RtJi__ueF9i5YVnWR0ISHubY/Hendra_GROMACS_LowpH_sim1_control_00002.mdp", | 371 | RtJi__ueF9i5YVnWR0ISHubY/Hendra_GROMACS_LowpH_sim1_control_00002.mdp", | ||
| 384 | "url_type": null | 372 | "url_type": null | ||
| 385 | }, | 373 | }, | ||
| 386 | { | 374 | { | ||
| 387 | "cache_last_updated": null, | 375 | "cache_last_updated": null, | ||
| 388 | "cache_url": null, | 376 | "cache_url": null, | ||
| 389 | "created": "2021-04-06T01:56:20.910990", | 377 | "created": "2021-04-06T01:56:20.910990", | ||
| 390 | "description": "", | 378 | "description": "", | ||
| 391 | "format": "itp", | 379 | "format": "itp", | ||
| 392 | "hash": "", | 380 | "hash": "", | ||
| 393 | "id": "941c93fc-a4f8-41af-99ce-6f0012501da9", | 381 | "id": "941c93fc-a4f8-41af-99ce-6f0012501da9", | ||
| 394 | "last_modified": null, | 382 | "last_modified": null, | ||
| 395 | "mimetype": null, | 383 | "mimetype": null, | ||
| 396 | "mimetype_inner": null, | 384 | "mimetype_inner": null, | ||
| 397 | "name": "hendra_low_ph_monomer_2.itp", | 385 | "name": "hendra_low_ph_monomer_2.itp", | ||
| 398 | "owner_org": "mduq", | 386 | "owner_org": "mduq", | ||
| 399 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | 387 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | ||
| 400 | "position": 14, | 388 | "position": 14, | ||
| 401 | "resource_type": "itp-files", | 389 | "resource_type": "itp-files", | ||
| 402 | "run": 2, | 390 | "run": 2, | ||
| 403 | "size": 861839, | 391 | "size": 861839, | ||
| 404 | "state": "active", | 392 | "state": "active", | ||
| 405 | "url": | 393 | "url": | ||
| 406 | bWFiQOdFOU4x33zh1VfAufyOwaWZvjFRsyn-T7qg/hendra_low_ph_monomer_2.itp", | 394 | bWFiQOdFOU4x33zh1VfAufyOwaWZvjFRsyn-T7qg/hendra_low_ph_monomer_2.itp", | ||
| 407 | "url_type": null | 395 | "url_type": null | ||
| 408 | }, | 396 | }, | ||
| 409 | { | 397 | { | ||
| 410 | "cache_last_updated": null, | 398 | "cache_last_updated": null, | ||
| 411 | "cache_url": null, | 399 | "cache_url": null, | ||
| 412 | "created": "2021-04-06T01:56:20.910992", | 400 | "created": "2021-04-06T01:56:20.910992", | ||
| 413 | "description": "", | 401 | "description": "", | ||
| 414 | "format": "xtc", | 402 | "format": "xtc", | ||
| 415 | "hash": "", | 403 | "hash": "", | ||
| 416 | "id": "c0e14ea9-ee85-471c-9c7b-44bc3566e344", | 404 | "id": "c0e14ea9-ee85-471c-9c7b-44bc3566e344", | ||
| 417 | "last_modified": null, | 405 | "last_modified": null, | ||
| 418 | "mimetype": null, | 406 | "mimetype": null, | ||
| 419 | "mimetype_inner": null, | 407 | "mimetype_inner": null, | ||
| 420 | "name": "Hendra_GROMACS_LowpH_sim1_trajectory_00002.xtc", | 408 | "name": "Hendra_GROMACS_LowpH_sim1_trajectory_00002.xtc", | ||
| 421 | "owner_org": "mduq", | 409 | "owner_org": "mduq", | ||
| 422 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | 410 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | ||
| 423 | "position": 15, | 411 | "position": 15, | ||
| 424 | "resource_type": "trajectory", | 412 | "resource_type": "trajectory", | ||
| 425 | "run": 2, | 413 | "run": 2, | ||
| 426 | "size": 119603108, | 414 | "size": 119603108, | ||
| 427 | "state": "active", | 415 | "state": "active", | ||
| 428 | "url": | 416 | "url": | ||
| 429 | EhVYUFvuK6AwgTzURjCZQ/Hendra_GROMACS_LowpH_sim1_trajectory_00002.xtc", | 417 | EhVYUFvuK6AwgTzURjCZQ/Hendra_GROMACS_LowpH_sim1_trajectory_00002.xtc", | ||
| 430 | "url_type": null | 418 | "url_type": null | ||
| 431 | }, | 419 | }, | ||
| 432 | { | 420 | { | ||
| 433 | "cache_last_updated": null, | 421 | "cache_last_updated": null, | ||
| 434 | "cache_url": null, | 422 | "cache_url": null, | ||
| 435 | "created": "2021-04-06T01:56:20.910993", | 423 | "created": "2021-04-06T01:56:20.910993", | ||
| 436 | "description": "", | 424 | "description": "", | ||
| 437 | "format": "tpr", | 425 | "format": "tpr", | ||
| 438 | "hash": "", | 426 | "hash": "", | ||
| 439 | "id": "4fcd836e-2511-4e54-b7a1-677f8b67da6a", | 427 | "id": "4fcd836e-2511-4e54-b7a1-677f8b67da6a", | ||
| 440 | "last_modified": null, | 428 | "last_modified": null, | ||
| 441 | "mimetype": null, | 429 | "mimetype": null, | ||
| 442 | "mimetype_inner": null, | 430 | "mimetype_inner": null, | ||
| 443 | "name": "Hendra_GROMACS_LowpH_sim1_input-coordinates_00002.tpr", | 431 | "name": "Hendra_GROMACS_LowpH_sim1_input-coordinates_00002.tpr", | ||
| 444 | "owner_org": "mduq", | 432 | "owner_org": "mduq", | ||
| 445 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | 433 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | ||
| 446 | "position": 16, | 434 | "position": 16, | ||
| 447 | "resource_type": "input-coordinates", | 435 | "resource_type": "input-coordinates", | ||
| 448 | "run": 2, | 436 | "run": 2, | ||
| 449 | "size": 23065052, | 437 | "size": 23065052, | ||
| 450 | "state": "active", | 438 | "state": "active", | ||
| 451 | "url": | 439 | "url": | ||
| 452 | VB3TiBiibh8hwU/Hendra_GROMACS_LowpH_sim1_input-coordinates_00002.tpr", | 440 | VB3TiBiibh8hwU/Hendra_GROMACS_LowpH_sim1_input-coordinates_00002.tpr", | ||
| 453 | "url_type": null | 441 | "url_type": null | ||
| 454 | }, | 442 | }, | ||
| 455 | { | 443 | { | ||
| 456 | "cache_last_updated": null, | 444 | "cache_last_updated": null, | ||
| 457 | "cache_url": null, | 445 | "cache_url": null, | ||
| 458 | "created": "2021-04-06T01:56:20.910995", | 446 | "created": "2021-04-06T01:56:20.910995", | ||
| 459 | "description": "", | 447 | "description": "", | ||
| 460 | "format": "log", | 448 | "format": "log", | ||
| 461 | "hash": "", | 449 | "hash": "", | ||
| 462 | "id": "d6435838-766d-4929-8d35-b35a887091d0", | 450 | "id": "d6435838-766d-4929-8d35-b35a887091d0", | ||
| 463 | "last_modified": null, | 451 | "last_modified": null, | ||
| 464 | "mimetype": null, | 452 | "mimetype": null, | ||
| 465 | "mimetype_inner": null, | 453 | "mimetype_inner": null, | ||
| 466 | "name": "Hendra_GROMACS_LowpH_sim1_log_00002.log", | 454 | "name": "Hendra_GROMACS_LowpH_sim1_log_00002.log", | ||
| 467 | "owner_org": "mduq", | 455 | "owner_org": "mduq", | ||
| 468 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | 456 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | ||
| 469 | "position": 17, | 457 | "position": 17, | ||
| 470 | "resource_type": "log", | 458 | "resource_type": "log", | ||
| 471 | "run": 2, | 459 | "run": 2, | ||
| 472 | "size": 124447, | 460 | "size": 124447, | ||
| 473 | "state": "active", | 461 | "state": "active", | ||
| 474 | "url": | 462 | "url": | ||
| 475 | EFA1wkAtKsnorf8ncpjBDxOqwIWM/Hendra_GROMACS_LowpH_sim1_log_00002.log", | 463 | EFA1wkAtKsnorf8ncpjBDxOqwIWM/Hendra_GROMACS_LowpH_sim1_log_00002.log", | ||
| 476 | "url_type": null | 464 | "url_type": null | ||
| 477 | }, | 465 | }, | ||
| 478 | { | 466 | { | ||
| 479 | "cache_last_updated": null, | 467 | "cache_last_updated": null, | ||
| 480 | "cache_url": null, | 468 | "cache_url": null, | ||
| 481 | "created": "2021-04-06T01:56:20.910997", | 469 | "created": "2021-04-06T01:56:20.910997", | ||
| 482 | "description": "", | 470 | "description": "", | ||
| 483 | "format": "edr", | 471 | "format": "edr", | ||
| 484 | "hash": "", | 472 | "hash": "", | ||
| 485 | "id": "df7f6c8e-ba6a-4c1e-88c7-c25266a2cec1", | 473 | "id": "df7f6c8e-ba6a-4c1e-88c7-c25266a2cec1", | ||
| 486 | "last_modified": null, | 474 | "last_modified": null, | ||
| 487 | "mimetype": null, | 475 | "mimetype": null, | ||
| 488 | "mimetype_inner": null, | 476 | "mimetype_inner": null, | ||
| 489 | "name": "Hendra_GROMACS_LowpH_sim1_energy_00002.edr", | 477 | "name": "Hendra_GROMACS_LowpH_sim1_energy_00002.edr", | ||
| 490 | "owner_org": "mduq", | 478 | "owner_org": "mduq", | ||
| 491 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | 479 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | ||
| 492 | "position": 18, | 480 | "position": 18, | ||
| 493 | "resource_type": "energy", | 481 | "resource_type": "energy", | ||
| 494 | "run": 2, | 482 | "run": 2, | ||
| 495 | "size": 34216, | 483 | "size": 34216, | ||
| 496 | "state": "active", | 484 | "state": "active", | ||
| 497 | "url": | 485 | "url": | ||
| 498 | kT2IGs8zbnpuDosWgk4H_dP_o/Hendra_GROMACS_LowpH_sim1_energy_00002.edr", | 486 | kT2IGs8zbnpuDosWgk4H_dP_o/Hendra_GROMACS_LowpH_sim1_energy_00002.edr", | ||
| 499 | "url_type": null | 487 | "url_type": null | ||
| 500 | }, | 488 | }, | ||
| 501 | { | 489 | { | ||
| 502 | "cache_last_updated": null, | 490 | "cache_last_updated": null, | ||
| 503 | "cache_url": null, | 491 | "cache_url": null, | ||
| 504 | "created": "2021-04-06T01:56:20.910999", | 492 | "created": "2021-04-06T01:56:20.910999", | ||
| 505 | "description": "", | 493 | "description": "", | ||
| 506 | "format": "gro", | 494 | "format": "gro", | ||
| 507 | "hash": "", | 495 | "hash": "", | ||
| 508 | "id": "a7bba2ee-1cf5-4034-aed0-370e5480c2f2", | 496 | "id": "a7bba2ee-1cf5-4034-aed0-370e5480c2f2", | ||
| 509 | "last_modified": null, | 497 | "last_modified": null, | ||
| 510 | "mimetype": null, | 498 | "mimetype": null, | ||
| 511 | "mimetype_inner": null, | 499 | "mimetype_inner": null, | ||
| 512 | "name": "Hendra_GROMACS_LowpH_sim1_final-coordinates_00002.gro", | 500 | "name": "Hendra_GROMACS_LowpH_sim1_final-coordinates_00002.gro", | ||
| 513 | "owner_org": "mduq", | 501 | "owner_org": "mduq", | ||
| 514 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | 502 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | ||
| 515 | "position": 19, | 503 | "position": 19, | ||
| 516 | "resource_type": "final-coordinates", | 504 | "resource_type": "final-coordinates", | ||
| 517 | "run": 2, | 505 | "run": 2, | ||
| 518 | "size": 28599657, | 506 | "size": 28599657, | ||
| 519 | "state": "active", | 507 | "state": "active", | ||
| 520 | "url": | 508 | "url": | ||
| 521 | G949zamwLQjSww/Hendra_GROMACS_LowpH_sim1_final-coordinates_00002.gro", | 509 | G949zamwLQjSww/Hendra_GROMACS_LowpH_sim1_final-coordinates_00002.gro", | ||
| 522 | "url_type": null | 510 | "url_type": null | ||
| 523 | }, | 511 | }, | ||
| 524 | { | 512 | { | ||
| 525 | "cache_last_updated": null, | 513 | "cache_last_updated": null, | ||
| 526 | "cache_url": null, | 514 | "cache_url": null, | ||
| 527 | "created": "2021-04-06T01:56:20.911000", | 515 | "created": "2021-04-06T01:56:20.911000", | ||
| 528 | "description": "", | 516 | "description": "", | ||
| 529 | "format": "mdp", | 517 | "format": "mdp", | ||
| 530 | "hash": "", | 518 | "hash": "", | ||
| 531 | "id": "dc9dd76c-3103-4f3f-9255-a4a6049131e0", | 519 | "id": "dc9dd76c-3103-4f3f-9255-a4a6049131e0", | ||
| 532 | "last_modified": null, | 520 | "last_modified": null, | ||
| 533 | "mimetype": null, | 521 | "mimetype": null, | ||
| 534 | "mimetype_inner": null, | 522 | "mimetype_inner": null, | ||
| 535 | "name": "Hendra_GROMACS_LowpH_sim1_control_00003.mdp", | 523 | "name": "Hendra_GROMACS_LowpH_sim1_control_00003.mdp", | ||
| 536 | "owner_org": "mduq", | 524 | "owner_org": "mduq", | ||
| 537 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | 525 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | ||
| 538 | "position": 20, | 526 | "position": 20, | ||
| 539 | "resource_type": "control", | 527 | "resource_type": "control", | ||
| 540 | "run": 3, | 528 | "run": 3, | ||
| 541 | "size": 11835, | 529 | "size": 11835, | ||
| 542 | "state": "active", | 530 | "state": "active", | ||
| 543 | "url": | 531 | "url": | ||
| 544 | AG1EeHwx_GWcSj1S9j9FFx84/Hendra_GROMACS_LowpH_sim1_control_00003.mdp", | 532 | AG1EeHwx_GWcSj1S9j9FFx84/Hendra_GROMACS_LowpH_sim1_control_00003.mdp", | ||
| 545 | "url_type": null | 533 | "url_type": null | ||
| 546 | }, | 534 | }, | ||
| 547 | { | 535 | { | ||
| 548 | "cache_last_updated": null, | 536 | "cache_last_updated": null, | ||
| 549 | "cache_url": null, | 537 | "cache_url": null, | ||
| 550 | "created": "2021-04-06T01:56:20.911002", | 538 | "created": "2021-04-06T01:56:20.911002", | ||
| 551 | "description": "", | 539 | "description": "", | ||
| 552 | "format": "xtc", | 540 | "format": "xtc", | ||
| 553 | "hash": "", | 541 | "hash": "", | ||
| 554 | "id": "50552d35-0141-4f4c-a329-903ba8ba4c84", | 542 | "id": "50552d35-0141-4f4c-a329-903ba8ba4c84", | ||
| 555 | "last_modified": null, | 543 | "last_modified": null, | ||
| 556 | "mimetype": null, | 544 | "mimetype": null, | ||
| 557 | "mimetype_inner": null, | 545 | "mimetype_inner": null, | ||
| 558 | "name": "Hendra_GROMACS_LowpH_sim1_trajectory_00003.xtc", | 546 | "name": "Hendra_GROMACS_LowpH_sim1_trajectory_00003.xtc", | ||
| 559 | "owner_org": "mduq", | 547 | "owner_org": "mduq", | ||
| 560 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | 548 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | ||
| 561 | "position": 21, | 549 | "position": 21, | ||
| 562 | "resource_type": "trajectory", | 550 | "resource_type": "trajectory", | ||
| 563 | "run": 3, | 551 | "run": 3, | ||
| 564 | "size": 119603096, | 552 | "size": 119603096, | ||
| 565 | "state": "active", | 553 | "state": "active", | ||
| 566 | "url": | 554 | "url": | ||
| 567 | 8ZhBiqQOo3fYRSsbmajUs/Hendra_GROMACS_LowpH_sim1_trajectory_00003.xtc", | 555 | 8ZhBiqQOo3fYRSsbmajUs/Hendra_GROMACS_LowpH_sim1_trajectory_00003.xtc", | ||
| 568 | "url_type": null | 556 | "url_type": null | ||
| 569 | }, | 557 | }, | ||
| 570 | { | 558 | { | ||
| 571 | "cache_last_updated": null, | 559 | "cache_last_updated": null, | ||
| 572 | "cache_url": null, | 560 | "cache_url": null, | ||
| 573 | "created": "2021-04-06T01:56:20.911004", | 561 | "created": "2021-04-06T01:56:20.911004", | ||
| 574 | "description": "", | 562 | "description": "", | ||
| 575 | "format": "tpr", | 563 | "format": "tpr", | ||
| 576 | "hash": "", | 564 | "hash": "", | ||
| 577 | "id": "10b11037-4c2f-4eec-aa9d-6d5cb065582a", | 565 | "id": "10b11037-4c2f-4eec-aa9d-6d5cb065582a", | ||
| 578 | "last_modified": null, | 566 | "last_modified": null, | ||
| 579 | "mimetype": null, | 567 | "mimetype": null, | ||
| 580 | "mimetype_inner": null, | 568 | "mimetype_inner": null, | ||
| 581 | "name": "Hendra_GROMACS_LowpH_sim1_input-coordinates_00003.tpr", | 569 | "name": "Hendra_GROMACS_LowpH_sim1_input-coordinates_00003.tpr", | ||
| 582 | "owner_org": "mduq", | 570 | "owner_org": "mduq", | ||
| 583 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | 571 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | ||
| 584 | "position": 22, | 572 | "position": 22, | ||
| 585 | "resource_type": "input-coordinates", | 573 | "resource_type": "input-coordinates", | ||
| 586 | "run": 3, | 574 | "run": 3, | ||
| 587 | "size": 23065052, | 575 | "size": 23065052, | ||
| 588 | "state": "active", | 576 | "state": "active", | ||
| 589 | "url": | 577 | "url": | ||
| 590 | MyFOVlJxNY0F9o/Hendra_GROMACS_LowpH_sim1_input-coordinates_00003.tpr", | 578 | MyFOVlJxNY0F9o/Hendra_GROMACS_LowpH_sim1_input-coordinates_00003.tpr", | ||
| 591 | "url_type": null | 579 | "url_type": null | ||
| 592 | }, | 580 | }, | ||
| 593 | { | 581 | { | ||
| 594 | "cache_last_updated": null, | 582 | "cache_last_updated": null, | ||
| 595 | "cache_url": null, | 583 | "cache_url": null, | ||
| 596 | "created": "2021-04-06T01:56:20.911006", | 584 | "created": "2021-04-06T01:56:20.911006", | ||
| 597 | "description": "", | 585 | "description": "", | ||
| 598 | "format": "log", | 586 | "format": "log", | ||
| 599 | "hash": "", | 587 | "hash": "", | ||
| 600 | "id": "a7da8aee-555b-4c40-b0fb-dd39cd6ccbc4", | 588 | "id": "a7da8aee-555b-4c40-b0fb-dd39cd6ccbc4", | ||
| 601 | "last_modified": null, | 589 | "last_modified": null, | ||
| 602 | "mimetype": null, | 590 | "mimetype": null, | ||
| 603 | "mimetype_inner": null, | 591 | "mimetype_inner": null, | ||
| 604 | "name": "Hendra_GROMACS_LowpH_sim1_log_00003.log", | 592 | "name": "Hendra_GROMACS_LowpH_sim1_log_00003.log", | ||
| 605 | "owner_org": "mduq", | 593 | "owner_org": "mduq", | ||
| 606 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | 594 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | ||
| 607 | "position": 23, | 595 | "position": 23, | ||
| 608 | "resource_type": "log", | 596 | "resource_type": "log", | ||
| 609 | "run": 3, | 597 | "run": 3, | ||
| 610 | "size": 124567, | 598 | "size": 124567, | ||
| 611 | "state": "active", | 599 | "state": "active", | ||
| 612 | "url": | 600 | "url": | ||
| 613 | SW2A3xsV8u63jtNoVePxvjbv9m3Q/Hendra_GROMACS_LowpH_sim1_log_00003.log", | 601 | SW2A3xsV8u63jtNoVePxvjbv9m3Q/Hendra_GROMACS_LowpH_sim1_log_00003.log", | ||
| 614 | "url_type": null | 602 | "url_type": null | ||
| 615 | }, | 603 | }, | ||
| 616 | { | 604 | { | ||
| 617 | "cache_last_updated": null, | 605 | "cache_last_updated": null, | ||
| 618 | "cache_url": null, | 606 | "cache_url": null, | ||
| 619 | "created": "2021-04-06T01:56:20.911007", | 607 | "created": "2021-04-06T01:56:20.911007", | ||
| 620 | "description": "", | 608 | "description": "", | ||
| 621 | "format": "edr", | 609 | "format": "edr", | ||
| 622 | "hash": "", | 610 | "hash": "", | ||
| 623 | "id": "06df093e-9ec5-46b7-a8ff-084a4698a7ed", | 611 | "id": "06df093e-9ec5-46b7-a8ff-084a4698a7ed", | ||
| 624 | "last_modified": null, | 612 | "last_modified": null, | ||
| 625 | "mimetype": null, | 613 | "mimetype": null, | ||
| 626 | "mimetype_inner": null, | 614 | "mimetype_inner": null, | ||
| 627 | "name": "Hendra_GROMACS_LowpH_sim1_energy_00003.edr", | 615 | "name": "Hendra_GROMACS_LowpH_sim1_energy_00003.edr", | ||
| 628 | "owner_org": "mduq", | 616 | "owner_org": "mduq", | ||
| 629 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | 617 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | ||
| 630 | "position": 24, | 618 | "position": 24, | ||
| 631 | "resource_type": "energy", | 619 | "resource_type": "energy", | ||
| 632 | "run": 3, | 620 | "run": 3, | ||
| 633 | "size": 34216, | 621 | "size": 34216, | ||
| 634 | "state": "active", | 622 | "state": "active", | ||
| 635 | "url": | 623 | "url": | ||
| 636 | 1t6aGDFfk21NAqY4PSwh2dc7A/Hendra_GROMACS_LowpH_sim1_energy_00003.edr", | 624 | 1t6aGDFfk21NAqY4PSwh2dc7A/Hendra_GROMACS_LowpH_sim1_energy_00003.edr", | ||
| 637 | "url_type": null | 625 | "url_type": null | ||
| 638 | }, | 626 | }, | ||
| 639 | { | 627 | { | ||
| 640 | "cache_last_updated": null, | 628 | "cache_last_updated": null, | ||
| 641 | "cache_url": null, | 629 | "cache_url": null, | ||
| 642 | "created": "2021-04-06T01:56:20.911009", | 630 | "created": "2021-04-06T01:56:20.911009", | ||
| 643 | "description": "", | 631 | "description": "", | ||
| 644 | "format": "gro", | 632 | "format": "gro", | ||
| 645 | "hash": "", | 633 | "hash": "", | ||
| 646 | "id": "36fa8110-a1d5-4dbc-a924-7c583c45247e", | 634 | "id": "36fa8110-a1d5-4dbc-a924-7c583c45247e", | ||
| 647 | "last_modified": null, | 635 | "last_modified": null, | ||
| 648 | "mimetype": null, | 636 | "mimetype": null, | ||
| 649 | "mimetype_inner": null, | 637 | "mimetype_inner": null, | ||
| 650 | "name": "Hendra_GROMACS_LowpH_sim1_final-coordinates_00003.gro", | 638 | "name": "Hendra_GROMACS_LowpH_sim1_final-coordinates_00003.gro", | ||
| 651 | "owner_org": "mduq", | 639 | "owner_org": "mduq", | ||
| 652 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | 640 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | ||
| 653 | "position": 25, | 641 | "position": 25, | ||
| 654 | "resource_type": "final-coordinates", | 642 | "resource_type": "final-coordinates", | ||
| 655 | "run": 3, | 643 | "run": 3, | ||
| 656 | "size": 28599657, | 644 | "size": 28599657, | ||
| 657 | "state": "active", | 645 | "state": "active", | ||
| 658 | "url": | 646 | "url": | ||
| 659 | M9QuTcqZej6ps4/Hendra_GROMACS_LowpH_sim1_final-coordinates_00003.gro", | 647 | M9QuTcqZej6ps4/Hendra_GROMACS_LowpH_sim1_final-coordinates_00003.gro", | ||
| 660 | "url_type": null | 648 | "url_type": null | ||
| 661 | }, | 649 | }, | ||
| 662 | { | 650 | { | ||
| 663 | "cache_last_updated": null, | 651 | "cache_last_updated": null, | ||
| 664 | "cache_url": null, | 652 | "cache_url": null, | ||
| 665 | "created": "2021-04-06T01:56:20.911011", | 653 | "created": "2021-04-06T01:56:20.911011", | ||
| 666 | "description": "", | 654 | "description": "", | ||
| 667 | "format": "mdp", | 655 | "format": "mdp", | ||
| 668 | "hash": "", | 656 | "hash": "", | ||
| 669 | "id": "db17e09c-87f0-44f1-bbe0-28ec90a672e1", | 657 | "id": "db17e09c-87f0-44f1-bbe0-28ec90a672e1", | ||
| 670 | "last_modified": null, | 658 | "last_modified": null, | ||
| 671 | "mimetype": null, | 659 | "mimetype": null, | ||
| 672 | "mimetype_inner": null, | 660 | "mimetype_inner": null, | ||
| 673 | "name": "Hendra_GROMACS_LowpH_sim1_control_00004.mdp", | 661 | "name": "Hendra_GROMACS_LowpH_sim1_control_00004.mdp", | ||
| 674 | "owner_org": "mduq", | 662 | "owner_org": "mduq", | ||
| 675 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | 663 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | ||
| 676 | "position": 26, | 664 | "position": 26, | ||
| 677 | "resource_type": "control", | 665 | "resource_type": "control", | ||
| 678 | "run": 4, | 666 | "run": 4, | ||
| 679 | "size": 11835, | 667 | "size": 11835, | ||
| 680 | "state": "active", | 668 | "state": "active", | ||
| 681 | "url": | 669 | "url": | ||
| 682 | EnwBRlmDkci4eZaQ_kzM_5nA/Hendra_GROMACS_LowpH_sim1_control_00004.mdp", | 670 | EnwBRlmDkci4eZaQ_kzM_5nA/Hendra_GROMACS_LowpH_sim1_control_00004.mdp", | ||
| 683 | "url_type": null | 671 | "url_type": null | ||
| 684 | }, | 672 | }, | ||
| 685 | { | 673 | { | ||
| 686 | "cache_last_updated": null, | 674 | "cache_last_updated": null, | ||
| 687 | "cache_url": null, | 675 | "cache_url": null, | ||
| 688 | "created": "2021-04-06T01:56:20.911013", | 676 | "created": "2021-04-06T01:56:20.911013", | ||
| 689 | "description": "", | 677 | "description": "", | ||
| 690 | "format": "xtc", | 678 | "format": "xtc", | ||
| 691 | "hash": "", | 679 | "hash": "", | ||
| 692 | "id": "38df1c26-727c-458c-b906-ff98ee027215", | 680 | "id": "38df1c26-727c-458c-b906-ff98ee027215", | ||
| 693 | "last_modified": null, | 681 | "last_modified": null, | ||
| 694 | "mimetype": null, | 682 | "mimetype": null, | ||
| 695 | "mimetype_inner": null, | 683 | "mimetype_inner": null, | ||
| 696 | "name": "Hendra_GROMACS_LowpH_sim1_trajectory_00004.xtc", | 684 | "name": "Hendra_GROMACS_LowpH_sim1_trajectory_00004.xtc", | ||
| 697 | "owner_org": "mduq", | 685 | "owner_org": "mduq", | ||
| 698 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | 686 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | ||
| 699 | "position": 27, | 687 | "position": 27, | ||
| 700 | "resource_type": "trajectory", | 688 | "resource_type": "trajectory", | ||
| 701 | "run": 4, | 689 | "run": 4, | ||
| 702 | "size": 119602352, | 690 | "size": 119602352, | ||
| 703 | "state": "active", | 691 | "state": "active", | ||
| 704 | "url": | 692 | "url": | ||
| 705 | hkPyPSaUzAXHbyOIW1C2I/Hendra_GROMACS_LowpH_sim1_trajectory_00004.xtc", | 693 | hkPyPSaUzAXHbyOIW1C2I/Hendra_GROMACS_LowpH_sim1_trajectory_00004.xtc", | ||
| 706 | "url_type": null | 694 | "url_type": null | ||
| 707 | }, | 695 | }, | ||
| 708 | { | 696 | { | ||
| 709 | "cache_last_updated": null, | 697 | "cache_last_updated": null, | ||
| 710 | "cache_url": null, | 698 | "cache_url": null, | ||
| 711 | "created": "2021-04-06T01:56:20.911014", | 699 | "created": "2021-04-06T01:56:20.911014", | ||
| 712 | "description": "", | 700 | "description": "", | ||
| 713 | "format": "tpr", | 701 | "format": "tpr", | ||
| 714 | "hash": "", | 702 | "hash": "", | ||
| 715 | "id": "87f4d2cf-73c1-43e4-8600-2dc530be4d36", | 703 | "id": "87f4d2cf-73c1-43e4-8600-2dc530be4d36", | ||
| 716 | "last_modified": null, | 704 | "last_modified": null, | ||
| 717 | "mimetype": null, | 705 | "mimetype": null, | ||
| 718 | "mimetype_inner": null, | 706 | "mimetype_inner": null, | ||
| 719 | "name": "Hendra_GROMACS_LowpH_sim1_input-coordinates_00004.tpr", | 707 | "name": "Hendra_GROMACS_LowpH_sim1_input-coordinates_00004.tpr", | ||
| 720 | "owner_org": "mduq", | 708 | "owner_org": "mduq", | ||
| 721 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | 709 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | ||
| 722 | "position": 28, | 710 | "position": 28, | ||
| 723 | "resource_type": "input-coordinates", | 711 | "resource_type": "input-coordinates", | ||
| 724 | "run": 4, | 712 | "run": 4, | ||
| 725 | "size": 23065052, | 713 | "size": 23065052, | ||
| 726 | "state": "active", | 714 | "state": "active", | ||
| 727 | "url": | 715 | "url": | ||
| 728 | F4q86C0rz-GVLA/Hendra_GROMACS_LowpH_sim1_input-coordinates_00004.tpr", | 716 | F4q86C0rz-GVLA/Hendra_GROMACS_LowpH_sim1_input-coordinates_00004.tpr", | ||
| 729 | "url_type": null | 717 | "url_type": null | ||
| 730 | }, | 718 | }, | ||
| 731 | { | 719 | { | ||
| 732 | "cache_last_updated": null, | 720 | "cache_last_updated": null, | ||
| 733 | "cache_url": null, | 721 | "cache_url": null, | ||
| 734 | "created": "2021-04-06T01:56:20.911016", | 722 | "created": "2021-04-06T01:56:20.911016", | ||
| 735 | "description": "", | 723 | "description": "", | ||
| 736 | "format": "log", | 724 | "format": "log", | ||
| 737 | "hash": "", | 725 | "hash": "", | ||
| 738 | "id": "76aabecb-5853-4208-8963-7259f28ac4a7", | 726 | "id": "76aabecb-5853-4208-8963-7259f28ac4a7", | ||
| 739 | "last_modified": null, | 727 | "last_modified": null, | ||
| 740 | "mimetype": null, | 728 | "mimetype": null, | ||
| 741 | "mimetype_inner": null, | 729 | "mimetype_inner": null, | ||
| 742 | "name": "Hendra_GROMACS_LowpH_sim1_log_00004.log", | 730 | "name": "Hendra_GROMACS_LowpH_sim1_log_00004.log", | ||
| 743 | "owner_org": "mduq", | 731 | "owner_org": "mduq", | ||
| 744 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | 732 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | ||
| 745 | "position": 29, | 733 | "position": 29, | ||
| 746 | "resource_type": "log", | 734 | "resource_type": "log", | ||
| 747 | "run": 4, | 735 | "run": 4, | ||
| 748 | "size": 124391, | 736 | "size": 124391, | ||
| 749 | "state": "active", | 737 | "state": "active", | ||
| 750 | "url": | 738 | "url": | ||
| 751 | CHr9JkxvDq3K1xVNh1Qq5XSyemN0/Hendra_GROMACS_LowpH_sim1_log_00004.log", | 739 | CHr9JkxvDq3K1xVNh1Qq5XSyemN0/Hendra_GROMACS_LowpH_sim1_log_00004.log", | ||
| 752 | "url_type": null | 740 | "url_type": null | ||
| 753 | }, | 741 | }, | ||
| 754 | { | 742 | { | ||
| 755 | "cache_last_updated": null, | 743 | "cache_last_updated": null, | ||
| 756 | "cache_url": null, | 744 | "cache_url": null, | ||
| 757 | "created": "2021-04-06T01:56:20.911018", | 745 | "created": "2021-04-06T01:56:20.911018", | ||
| 758 | "description": "", | 746 | "description": "", | ||
| 759 | "format": "edr", | 747 | "format": "edr", | ||
| 760 | "hash": "", | 748 | "hash": "", | ||
| 761 | "id": "a0b3920e-c522-4067-bea1-1c99530a37fe", | 749 | "id": "a0b3920e-c522-4067-bea1-1c99530a37fe", | ||
| 762 | "last_modified": null, | 750 | "last_modified": null, | ||
| 763 | "mimetype": null, | 751 | "mimetype": null, | ||
| 764 | "mimetype_inner": null, | 752 | "mimetype_inner": null, | ||
| 765 | "name": "Hendra_GROMACS_LowpH_sim1_energy_00004.edr", | 753 | "name": "Hendra_GROMACS_LowpH_sim1_energy_00004.edr", | ||
| 766 | "owner_org": "mduq", | 754 | "owner_org": "mduq", | ||
| 767 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | 755 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | ||
| 768 | "position": 30, | 756 | "position": 30, | ||
| 769 | "resource_type": "energy", | 757 | "resource_type": "energy", | ||
| 770 | "run": 4, | 758 | "run": 4, | ||
| 771 | "size": 34216, | 759 | "size": 34216, | ||
| 772 | "state": "active", | 760 | "state": "active", | ||
| 773 | "url": | 761 | "url": | ||
| 774 | zXC0ceRnrvKAvbltgjrLZ_no8/Hendra_GROMACS_LowpH_sim1_energy_00004.edr", | 762 | zXC0ceRnrvKAvbltgjrLZ_no8/Hendra_GROMACS_LowpH_sim1_energy_00004.edr", | ||
| 775 | "url_type": null | 763 | "url_type": null | ||
| 776 | }, | 764 | }, | ||
| 777 | { | 765 | { | ||
| 778 | "cache_last_updated": null, | 766 | "cache_last_updated": null, | ||
| 779 | "cache_url": null, | 767 | "cache_url": null, | ||
| 780 | "created": "2021-04-06T01:56:20.911020", | 768 | "created": "2021-04-06T01:56:20.911020", | ||
| 781 | "description": "", | 769 | "description": "", | ||
| 782 | "format": "gro", | 770 | "format": "gro", | ||
| 783 | "hash": "", | 771 | "hash": "", | ||
| 784 | "id": "9eed94e0-4b0c-4050-9d4c-e85c2dc54ee8", | 772 | "id": "9eed94e0-4b0c-4050-9d4c-e85c2dc54ee8", | ||
| 785 | "last_modified": null, | 773 | "last_modified": null, | ||
| 786 | "mimetype": null, | 774 | "mimetype": null, | ||
| 787 | "mimetype_inner": null, | 775 | "mimetype_inner": null, | ||
| 788 | "name": "Hendra_GROMACS_LowpH_sim1_final-coordinates_00004.gro", | 776 | "name": "Hendra_GROMACS_LowpH_sim1_final-coordinates_00004.gro", | ||
| 789 | "owner_org": "mduq", | 777 | "owner_org": "mduq", | ||
| 790 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | 778 | "package_id": "a4e6b64d-d957-48ec-9fa2-2f2f6baece52", | ||
| 791 | "position": 31, | 779 | "position": 31, | ||
| 792 | "resource_type": "final-coordinates", | 780 | "resource_type": "final-coordinates", | ||
| 793 | "run": 4, | 781 | "run": 4, | ||
| 794 | "size": 28599657, | 782 | "size": 28599657, | ||
| 795 | "state": "active", | 783 | "state": "active", | ||
| 796 | "url": | 784 | "url": | ||
| 797 | gLVOOdBNW-DCps/Hendra_GROMACS_LowpH_sim1_final-coordinates_00004.gro", | 785 | gLVOOdBNW-DCps/Hendra_GROMACS_LowpH_sim1_final-coordinates_00004.gro", | ||
| 798 | "url_type": null | 786 | "url_type": null | ||
| 799 | } | 787 | } | ||
| 800 | ], | 788 | ], | ||
| 801 | "state": "active", | 789 | "state": "active", | ||
| 802 | "tags": [ | 790 | "tags": [ | ||
| 803 | { | 791 | { | ||
| 804 | "display_name": "54A7", | 792 | "display_name": "54A7", | ||
| 805 | "id": "186c2258-e1ec-4d82-943e-14c6c00ec855", | 793 | "id": "186c2258-e1ec-4d82-943e-14c6c00ec855", | ||
| 806 | "name": "54A7", | 794 | "name": "54A7", | ||
| 807 | "state": "active", | 795 | "state": "active", | ||
| 808 | "vocabulary_id": null | 796 | "vocabulary_id": null | ||
| 809 | }, | 797 | }, | ||
| 810 | { | 798 | { | ||
| 811 | "display_name": "Berendsen", | 799 | "display_name": "Berendsen", | ||
| 812 | "id": "97110ec0-faca-42ad-9a1a-1dd9bd78f893", | 800 | "id": "97110ec0-faca-42ad-9a1a-1dd9bd78f893", | ||
| 813 | "name": "Berendsen", | 801 | "name": "Berendsen", | ||
| 814 | "state": "active", | 802 | "state": "active", | ||
| 815 | "vocabulary_id": "8c74f898-b8fb-4f9c-80d5-765e879156ac" | 803 | "vocabulary_id": "8c74f898-b8fb-4f9c-80d5-765e879156ac" | ||
| 816 | }, | 804 | }, | ||
| 817 | { | 805 | { | ||
| 818 | "display_name": "Berendsen", | 806 | "display_name": "Berendsen", | ||
| 819 | "id": "4be16f6f-d0c9-4a96-bedb-4b39b9bded16", | 807 | "id": "4be16f6f-d0c9-4a96-bedb-4b39b9bded16", | ||
| 820 | "name": "Berendsen", | 808 | "name": "Berendsen", | ||
| 821 | "state": "active", | 809 | "state": "active", | ||
| 822 | "vocabulary_id": "633936e4-0e63-4bf8-83c1-3268ecbe0a43" | 810 | "vocabulary_id": "633936e4-0e63-4bf8-83c1-3268ecbe0a43" | ||
| 823 | }, | 811 | }, | ||
| 824 | { | 812 | { | ||
| 825 | "display_name": "GROMACS", | 813 | "display_name": "GROMACS", | ||
| 826 | "id": "aa59184c-ef5d-4179-8ed3-ef3bc97fa1f0", | 814 | "id": "aa59184c-ef5d-4179-8ed3-ef3bc97fa1f0", | ||
| 827 | "name": "GROMACS", | 815 | "name": "GROMACS", | ||
| 828 | "state": "active", | 816 | "state": "active", | ||
| 829 | "vocabulary_id": "e2f1fbe0-9f4c-434c-b6a8-062fb974313a" | 817 | "vocabulary_id": "e2f1fbe0-9f4c-434c-b6a8-062fb974313a" | ||
| 830 | }, | 818 | }, | ||
| 831 | { | 819 | { | ||
| 832 | "display_name": "GROMACS", | 820 | "display_name": "GROMACS", | ||
| 833 | "id": "27036687-06ca-4112-a549-deef00249e37", | 821 | "id": "27036687-06ca-4112-a549-deef00249e37", | ||
| 834 | "name": "GROMACS", | 822 | "name": "GROMACS", | ||
| 835 | "state": "active", | 823 | "state": "active", | ||
| 836 | "vocabulary_id": null | 824 | "vocabulary_id": null | ||
| 837 | }, | 825 | }, | ||
| 838 | { | 826 | { | ||
| 839 | "display_name": "No. atoms at least 10000", | 827 | "display_name": "No. atoms at least 10000", | ||
| 840 | "id": "dc8da662-312e-4520-88fc-27229dffb7d2", | 828 | "id": "dc8da662-312e-4520-88fc-27229dffb7d2", | ||
| 841 | "name": "No. atoms at least 10000", | 829 | "name": "No. atoms at least 10000", | ||
| 842 | "state": "active", | 830 | "state": "active", | ||
| 843 | "vocabulary_id": null | 831 | "vocabulary_id": null | ||
| 844 | }, | 832 | }, | ||
| 845 | { | 833 | { | ||
| 846 | "display_name": "PDB-5ejb", | 834 | "display_name": "PDB-5ejb", | ||
| 847 | "id": "51ef3faa-7b66-49ec-ab14-51a012857b58", | 835 | "id": "51ef3faa-7b66-49ec-ab14-51a012857b58", | ||
| 848 | "name": "PDB-5ejb", | 836 | "name": "PDB-5ejb", | ||
| 849 | "state": "active", | 837 | "state": "active", | ||
| 850 | "vocabulary_id": null | 838 | "vocabulary_id": null | ||
| 851 | }, | 839 | }, | ||
| 852 | { | 840 | { | ||
| 853 | "display_name": "Simulation time at least 10 ns", | 841 | "display_name": "Simulation time at least 10 ns", | ||
| 854 | "id": "661d151e-ae87-4b98-8ca6-0fd017ffafad", | 842 | "id": "661d151e-ae87-4b98-8ca6-0fd017ffafad", | ||
| 855 | "name": "Simulation time at least 10 ns", | 843 | "name": "Simulation time at least 10 ns", | ||
| 856 | "state": "active", | 844 | "state": "active", | ||
| 857 | "vocabulary_id": null | 845 | "vocabulary_id": null | ||
| 858 | }, | 846 | }, | ||
| 859 | { | 847 | { | ||
| 860 | "display_name": "barostat is Berendsen", | 848 | "display_name": "barostat is Berendsen", | ||
| 861 | "id": "20b3f9a5-946a-4481-8e7d-d6cfa4622b1c", | 849 | "id": "20b3f9a5-946a-4481-8e7d-d6cfa4622b1c", | ||
| 862 | "name": "barostat is Berendsen", | 850 | "name": "barostat is Berendsen", | ||
| 863 | "state": "active", | 851 | "state": "active", | ||
| 864 | "vocabulary_id": null | 852 | "vocabulary_id": null | ||
| 865 | }, | 853 | }, | ||
| 866 | { | 854 | { | ||
| 867 | "display_name": "fusion protein in solution", | 855 | "display_name": "fusion protein in solution", | ||
| 868 | "id": "40ed0cf5-938c-4689-bfd0-61312e1c8be3", | 856 | "id": "40ed0cf5-938c-4689-bfd0-61312e1c8be3", | ||
| 869 | "name": "fusion protein in solution", | 857 | "name": "fusion protein in solution", | ||
| 870 | "state": "active", | 858 | "state": "active", | ||
| 871 | "vocabulary_id": null | 859 | "vocabulary_id": null | ||
| 872 | }, | 860 | }, | ||
| 873 | { | 861 | { | ||
| 874 | "display_name": "protein-Hendra virus fusion protein F1 F2", | 862 | "display_name": "protein-Hendra virus fusion protein F1 F2", | ||
| 875 | "id": "aa467add-b296-41cf-9eb7-e35e0801cc8d", | 863 | "id": "aa467add-b296-41cf-9eb7-e35e0801cc8d", | ||
| 876 | "name": "protein-Hendra virus fusion protein F1 F2", | 864 | "name": "protein-Hendra virus fusion protein F1 F2", | ||
| 877 | "state": "active", | 865 | "state": "active", | ||
| 878 | "vocabulary_id": null | 866 | "vocabulary_id": null | ||
| 879 | }, | 867 | }, | ||
| 880 | { | 868 | { | ||
| 881 | "display_name": "replicate-1 of 3", | 869 | "display_name": "replicate-1 of 3", | ||
| 882 | "id": "c59d4a1c-f1a5-4323-b504-a146842ad1a1", | 870 | "id": "c59d4a1c-f1a5-4323-b504-a146842ad1a1", | ||
| 883 | "name": "replicate-1 of 3", | 871 | "name": "replicate-1 of 3", | ||
| 884 | "state": "active", | 872 | "state": "active", | ||
| 885 | "vocabulary_id": null | 873 | "vocabulary_id": null | ||
| 886 | }, | 874 | }, | ||
| 887 | { | 875 | { | ||
| 888 | "display_name": "solvent-H2O", | 876 | "display_name": "solvent-H2O", | ||
| 889 | "id": "a21b0566-4486-494c-b670-aad8031d7c4e", | 877 | "id": "a21b0566-4486-494c-b670-aad8031d7c4e", | ||
| 890 | "name": "solvent-H2O", | 878 | "name": "solvent-H2O", | ||
| 891 | "state": "active", | 879 | "state": "active", | ||
| 892 | "vocabulary_id": null | 880 | "vocabulary_id": null | ||
| 893 | }, | 881 | }, | ||
| 894 | { | 882 | { | ||
| 895 | "display_name": "thermostat is Berendsen", | 883 | "display_name": "thermostat is Berendsen", | ||
| 896 | "id": "4fb82905-f20b-444e-9ba9-93e5d793c273", | 884 | "id": "4fb82905-f20b-444e-9ba9-93e5d793c273", | ||
| 897 | "name": "thermostat is Berendsen", | 885 | "name": "thermostat is Berendsen", | ||
| 898 | "state": "active", | 886 | "state": "active", | ||
| 899 | "vocabulary_id": null | 887 | "vocabulary_id": null | ||
| 900 | } | 888 | } | ||
| 901 | ], | 889 | ], | ||
| 902 | "title": "Hendra virus fusion protein low pH 1/3", | 890 | "title": "Hendra virus fusion protein low pH 1/3", | ||
| 903 | "type": "dataset", | 891 | "type": "dataset", | ||
| 904 | "url": "", | 892 | "url": "", | ||
| 905 | "version": "" | 893 | "version": "" | ||
| 906 | } | 894 | } |