Drug-membrane transfer free energies for coarse-grained trimers and tetramers
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Dataset:6709165
DOI10.5281/zenodo.2668206Zenodo2668206MaRDI QIDQ6709165FDOQ6709165
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
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
