Deprecated: $wgMWOAuthSharedUserIDs=false is deprecated, set $wgMWOAuthSharedUserIDs=true, $wgMWOAuthSharedUserSource='local' instead [Called from MediaWiki\HookContainer\HookContainer::run in /var/www/html/w/includes/HookContainer/HookContainer.php at line 135] in /var/www/html/w/includes/Debug/MWDebug.php on line 372
Drug-membrane transfer free energies for coarse-grained trimers and tetramers - MaRDI portal

Drug-membrane transfer free energies for coarse-grained trimers and tetramers

From MaRDI portal
Dataset:6709165



DOI10.5281/zenodo.2668206Zenodo2668206MaRDI QIDQ6709165

Dataset published at Zenodo repository.

Roberto Menichetti, Kiran H. Kanekal, Tristan Bereau, Christian Hoffmann

Publication date: 5 April 2019

Copyright license: Creative Commons Attribution 4.0 International



Description

The databases containdrug-membrane transfer free energies for coarse-grained Martini trimers and tetramers inserted in a one-component DOPC membrane. We also provide a database of atomistic-resolution compounds mined from the GDB and that mapto trimers.






This page was built for dataset: Drug-membrane transfer free energies for coarse-grained trimers and tetramers

Retrieved from "https://portal.mardi4nfdi.de/w/index.php?title=Dataset:6709165&oldid=40437615"
Powered by MediaWiki