Joshua A. Mitchell

OpenMM 8: Molecular Dynamics Simulation with Machine Learning Potentials

Peter Eastman, Raimondas Galvelis, Raúl P. Peláez et al. · The Journal of Physical Chemistry B · 2023 · 350 citations · Full text

Engineering, Machine Learning, Physics +15

Monitoring hippocampal glycine with the computationally designed optical sensor GlyFS

William Zhang, Michel K. Herde, Joshua A. Mitchell et al. · Nature Chemical Biology · 2018 · 70 citations

Engineering, Neurophysiology, Computational Neuroscience +13

Open Force Field BespokeFit: Automating Bespoke Torsion Parametrization at Scale

Joshua T. Horton, Simon Boothroyd, Jeffrey Wagner et al. · Journal of Chemical Information and Modeling · 2022 · 55 citations · Full text

T-dependent B cell responses to Plasmodium induce antibodies that form a high-avidity multivalent complex with the circumsporozoite protein

Camilla R. Fisher, Henry J. Sutton, Joe A. Kaczmarski et al. · PLoS Pathogens · 2017 · 54 citations · Full text

Adaptive Immune System, Malaria, Immunology +17

OpenMM 8: Molecular Dynamics Simulation with Machine Learning Potentials

Peter Eastman, Raimondas Galvelis, Raúl P. Peláez et al. · arXiv (Cornell University) · 2023 · 20 citations · Full text