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4_Prod.ncrst.8Download
alpham_ROX_apo_solv.prmtopDownload
4_Prod.ncrst.7Download
4_Prod.nc.8Download
output.cmlDownload
4_Prod.inDownload
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dc.contributor.authorCurti, Mariano
dc.date.accessioned2025-11-07T09:55:37Z-
dc.date.available2025-11-07T10:54:26.883122+01:00
dc.date.available2025-11-07T09:55:37Z-
dc.date.created2025-11-07T10:54:26.883122+01:00
dc.date.issued2025-11-07T10:54:26.883122+01:00
dc.identifier.urihttps://iochem-bd.bsc.es/browse/handle/100/479730-
dc.description.abstractMD for ROX:1, 320-360 ns
dc.publisherUniversitat de Barcelona
dc.relation.ispartofhttp://dx.doi.org/10.19061/iochem-bd-6-601-
dc.rightsCC BY 4.0 (c) Barcelona Supercomputing Center, 2025
dc.rights.urihttp://creativecommons.org/licenses/by/4.0/
dc.titleprotein1_rox_md9
dc.typedataset
cml.program.nameAmber
cml.program.version22
cml.energy.value-205.31096915519998
cml.energy.unitsEh
cml.formula.genericC682H996N176O223S
cml.calculationtypeMolecular Dynamics
cml.hassolventtrue
cml.hasvibrationalfrequenciesfalse
cml.numberofjobs1
cml.hasmolecularorbitalsfalse
Appears in Collections:Multipigments_Light_Harvesters - DOI: 10.19061/iochem-bd-6-601



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