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Physical Chemistry, Chemical Physics - PCCP, 2019
Enhanced sampling has been extensively used to capture the conformational transitions in protein folding, but it attracts much less attention in the studies of protein-protein recognition.
Ercheng Wang +7 more
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Enhanced sampling has been extensively used to capture the conformational transitions in protein folding, but it attracts much less attention in the studies of protein-protein recognition.
Ercheng Wang +7 more
semanticscholar +1 more source
1997
Abstract M symbol for 1 mass, especially molar mass; related terms aredesignated by subscripts: Mm , symbol for mass-average molarmass (see average molar mass); M0, symbol for number-averagemolar mass (see average molar mass); M0, symbol for mean relativeresidue mass; Mr, symbol for relative molecular mass; Mw ,symbol for weight-average ...
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Abstract M symbol for 1 mass, especially molar mass; related terms aredesignated by subscripts: Mm , symbol for mass-average molarmass (see average molar mass); M0, symbol for number-averagemolar mass (see average molar mass); M0, symbol for mean relativeresidue mass; Mr, symbol for relative molecular mass; Mw ,symbol for weight-average ...
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g_mmpbsa - A GROMACS Tool for High-Throughput MM-PBSA Calculations
Journal of Chemical Information and Modeling, 2014R. Kumari, R. Kumar, A. Lynn
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Improving virtual screening results with MM/GBSA and MM/PBSA rescoring
Journal of Computer-Aided Molecular Design, 2021Harutyun Sahakyan
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QM/MM methods for biomolecular systems.
Angewandte Chemie, 2009H. Senn, W. Thiel
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