ioChem-BD Browse module - Item page
Item metadata and files
Code snippets
Referenced by:
Manuscript title: De novo design of proteins housing excitonically coupled chlorophyll special pairs
Full metadata record
| DC Field | Value | Language |
|---|---|---|
| dc.contributor.author | Curti, Mariano | - |
| dc.coverage.spatial | ES Barcelona | - |
| dc.date.accessioned | 2023-02-22T09:41:40Z | - |
| dc.date.available | 2023-07-28T08:39:57Z | - |
| dc.date.created | 2023-02-22T10:41:07.787+01:00 | - |
| dc.date.issued | 2023-02-22T10:41:07.787+01:00 | - |
| dc.identifier.uri | https://iochem-bd.bsc.es/browse/handle/100/275874 | - |
| dc.description | MD for SP2, from crystal structure, 0-100 ns | - |
| dc.publisher | Institut Català d'Investigació Química | - |
| dc.relation | Original title: De novo design of proteins housing excitonically coupled chlorophyll special pairs DOI: 10.1038/s41589-024-01626-0 | * |
| dc.relation.ispartof | http://dx.doi.org/10.19061/iochem-bd-6-268 | - |
| dc.relation.uri | http://dx.doi.org/10.1038/s41589-024-01626-0 | * |
| dc.rights | CC BY 4.0 (c) Barcelona Supercomputing Center, 2023 | - |
| dc.rights.uri | http://creativecommons.org/licenses/by/4.0/ | - |
| dc.title | SP2_crystal_md0 | - |
| dc.type | dataset | - |
| dc.date.updated | 2023-02-22T09:41:36Z | - |
| cml.program.name | Amber | en |
| cml.program.version | 18 | en |
| cml.energy.value | -216.82628801471998 | en |
| cml.energy.units | Eh | en |
| cml.formula.generic | C2443H3949N659O740S12Zn2 | en |
| cml.calculationtype | Molecular Dynamics | en |
| cml.hassolvent | true | en |
| cml.hasvibrationalfrequencies | false | en |
| cml.numberofjobs | 1 | en |
| cml.hasmolecularorbitals | false | en |
| Appears in Collections: | Chromophore_dimers_via_designed_proteins - DOI: 10.19061/iochem-bd-6-268 | |
Please use this identifier to cite or link to this item:
https://iochem-bd.bsc.es/browse/handle/100/275874
Item files in Browse 
HTML5 resume (see conditions inside)