HpTonB(30-285) simulation Amber ff99SB-ILDN

dc.contributor.affiliationUniversity of Helsinki-Ollila, O. H. Samuli
dc.contributor.authorOllila, O. H. Samuli
dc.date.accessioned2025-04-29T14:01:25Z
dc.date.issued2020-04-16
dc.date.issued2020-04-16
dc.descriptionSimulation of periplasmic part of TonB protein from Helicobacter Pylori HpTonB(30-285) with Amber ff99SB-ILDN force field. Trajectory contains the whole 387ns simulation. The conformational ensemble is too collapsed here according to the comparison with experimental spin relaxation data.
dc.identifierhttps://doi.org/10.5281/zenodo.3754109
dc.identifier.urihttps://datakatalogi.helsinki.fi/handle/123456789/4943
dc.rights.licensecc-by-4.0
dc.titleHpTonB(30-285) simulation Amber ff99SB-ILDN
dc.typedataset