93 citations · 205 across the 16 of their papers we have counts for
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cond-mat.stat-mech2022★ 2 cited
Understanding the Sources of Error in MBAR through Asymptotic Analysis
Xiang Sherry Li, Brian Van Koten, Aaron R. Dinner +1
Multiple sampling strategies commonly used in molecular dynamics, such as umbrella sampling and alchemical free energy methods, involve sampling from multiple thermodynamic states.…
cond-mat.stat-mech2016★ 31 cited
Eigenvector method for umbrella sampling enables error analysis
Erik Thiede, Brian Van Koten, Jonathan Weare +1
Umbrella sampling efficiently yields equilibrium averages that depend on exploring rare states of a model by biasing simulations to windows of coordinate values and then combining…