Comprehensive 3D-RISM analysis of the hydration of small molecule binding sites in ligand-free protein structures

Comprehensive 3D-RISM analysis of the hydration of small molecule binding sites in ligand-free protein structures

© 2020 The Authors. Journal of Computational Chemistry published by Wiley Periodicals LLC.

Bibliographische Detailangaben
Veröffentlicht in:Journal of computational chemistry. - 1984. - 41(2020), 28 vom: 30. Okt., Seite 2406-2419
1. Verfasser: Yoshidome, Takashi (VerfasserIn)
Weitere Verfasser: Ikeguchi, Mitsunori, Ohta, Masateru
Format: Online-Aufsatz
Sprache:English
Veröffentlicht: 2020
Zugriff auf das übergeordnete Werk:Journal of computational chemistry
Schlagworte:Journal Article Research Support, Non-U.S. Gov't distribution functions of water hydration state hydrogen bonds ligand binding statistical mechanical theory of solvation Ligands Proteins Solvents mehr... Water 059QF0KO0R
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