Feb 1, 2007 � We have performed a comprehensive analysis of water molecules at the protein−ligand interfaces observed in 392 high-resolution crystal structures.
Analysis of ligand-bound water molecules in high-resolution crystal ...
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We have performed a comprehensive analysis of water molecules at the protein-ligand interfaces observed in 392 high-resolution crystal structures.
A comprehensive analysis of water molecules at the protein-ligand interfaces observed in 392 high-resolution crystal structures found that there is only a�...
We have performed a comprehensive analysis of water molecules at the protein-ligand interfaces observed in 392 high-resolution crystal structures.
Feb 1, 2007 � We have performed a comprehensive analysis of water molecules at the protein-ligand interfaces observed in 392 high-resolution crystal�...
Bibliographic details on Analysis of Ligand-Bound Water Molecules in High-Resolution Crystal Structures of Protein-Ligand Complexes.
Sep 3, 2018 � The ligand-free binding pocket is occupied by water molecules characterized by a paucity of H-bonds and high mobility resulting in an imperfect hydration.
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Analysis of Ligand-Bound Water Molecules in High-Resolution Crystal Structures of Protein−Ligand Complexes. https://doi.org/10.1021/ci6003527 � Full text.
Aug 30, 2021 � Water molecules play a crucial role in protein–ligand binding, and many tools exist that aim to predict the position and relative energies�...
Sep 14, 2020 � This review reports on recent advances of prediction of water structure and function in the context of ligand engineering.