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Advanced Potential Energy Surfaces for Molecular Simulation

artículo científico publicado en 2016

Comparing experimental and computational alanine scanning techniques for probing a prototypical protein–protein interaction

scientific article published on 23 July 2010

Evaluating Anti-CD32b F(ab) Conformation Using Molecular Dynamics and Small-Angle X-Ray Scattering

scientific article published on 01 July 2018

Evaluating Parametrization Protocols for Hydration Free Energy Calculations with the AMOEBA Polarizable Force Field

artículo científico publicado en 2016

Evaluation of solvation free energies for small molecules with the AMOEBA polarizable force field

artículo científico publicado en 2016

Interpreting hydrogen-deuterium exchange experiments with molecular simulations: Tutorials and applications of the HDXer ensemble reweighting software [Article v1.0]

artículo científico publicado en 2022

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