Concepedia

Samuel C. Gill

SC

Statistics

Publications

4

Citations

177

H-Index

4

Active since

2018

Affiliations

University of California, Irvine(Current)

Samuel C. Gill is an author at University of California, Irvine specializing in protein-ligand binding free energy calculations, computational chemistry, and natural sciences.

Publications per year

2018–2020

4

Publications

4

Binding Modes of Ligands Using Enhanced Sampling (BLUES): Rapid Decorrelation of Ligand Binding Modes via Nonequilibrium Candidate Monte Carlo

Samuel C. Gill, Nathan M. Lim, Patrick Grinaway et al. · The Journal of Physical Chemistry B · 2018 · 90 citations · Full text

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Enhancing Side Chain Rotamer Sampling Using Nonequilibrium Candidate Monte Carlo

Kalistyn H. Burley, Samuel C. Gill, Nathan M. Lim et al. · Journal of Chemical Theory and Computation · 2019 · 30 citations · Full text

, , +17

Sampling Conformational Changes of Bound Ligands Using Nonequilibrium Candidate Monte Carlo and Molecular Dynamics

Sukanya Sasmal, Samuel C. Gill, Nathan M. Lim et al. · Journal of Chemical Theory and Computation · 2020 · 29 citations · Full text

, , +17

Binding Modes and Metabolism of Caffeine

Zuzana Jandová, Samuel C. Gill, Nathan M. Lim et al. · Chemical Research in Toxicology · 2019 · 28 citations · Full text

, , +17

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