Physics – Computational Physics
Scientist
Physics
Computational Physics
Scientist
A library-based Monte Carlo technique enables rapid equilibrium sampling of a protein model with atomistic components
Automated sampling assessment for molecular simulations using the effective sample size
Biomolecular transitions: efficient computation of pathways, free energies, and rates
Heterogeneous path ensembles for conformational transitions in semi-atomistic models of adenylate kinase
Steady-state simulations using weighted ensemble path sampling
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