Efficient estimation of binding free energies between peptides and an MHC class II molecule using coarse-grained molecular dynamics simulations with a weighted histogram analysis method

Efficient estimation of binding free energies between peptides and an MHC class II molecule using coarse-grained molecular dynamics simulations with a weighted histogram analysis method

© 2017 Wiley Periodicals, Inc.

Bibliographische Detailangaben
Veröffentlicht in:Journal of computational chemistry. - 1984. - 38(2017), 23 vom: 05. Sept., Seite 2007-2019
1. Verfasser: Huang, Ming (VerfasserIn)
Weitere Verfasser: Huang, Wenjun, Wen, Fei, Larson, Ronald G
Format: Online-Aufsatz
Sprache:English
Veröffentlicht: 2017
Zugriff auf das übergeordnete Werk:Journal of computational chemistry
Schlagworte:Journal Article Research Support, Non-U.S. Gov't MHC binding free energy coarse-grained peptide peptide-MHC binding affinity umbrella sampling method
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