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4_Prod.inDownload
final.1.ncrstDownload
mZnPPA_solv.prmtopDownload
4_Prod.ncrst.0Download
4_Prod.nc.0Download
output.cmlDownload
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dc.contributor.authorCurti, Mariano-
dc.coverage.spatialES Barcelona-
dc.date.accessioned2023-02-21T08:24:27Z-
dc.date.available2023-07-28T08:40:01Z-
dc.date.created2023-02-21T09:23:42.294+01:00-
dc.date.issued2023-02-21T09:23:42.294+01:00-
dc.identifier.urihttps://iochem-bd.bsc.es/browse/handle/100/275748-
dc.descriptionMD for SP1, from crystal structure, 0-100 ns-
dc.publisherInstitut Català d'Investigació Química-
dc.relation.ispartofhttp://dx.doi.org/10.19061/iochem-bd-6-268-
dc.rightsCC BY 4.0 (c) Barcelona Supercomputing Center, 2023-
dc.rights.urihttp://creativecommons.org/licenses/by/4.0/-
dc.subjectMolecular dynamics-
dc.subjectExcitonic coupling-
dc.subjectArtificial photosynthesis-
dc.subjectCircular dichroism-
dc.subjectProtein design-
dc.titleSP1_crystal_md0-
dc.typedataset-
dc.date.updated2023-02-21T08:24:20Z-
cml.program.nameAmberen
cml.program.version18en
cml.energy.value-258.52869343488en
cml.energy.unitsEhen
cml.formula.genericC2200H3598N623O665S8Zn2en
cml.calculationtypeMolecular Dynamicsen
cml.hassolventtrueen
cml.hasvibrationalfrequenciesfalseen
cml.numberofjobs1en
cml.hasmolecularorbitalsfalseen
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/100/275748

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