Louis G. Smith

Apolipoprotein E4 has extensive conformational heterogeneity in lipid-free and lipid-bound forms

Melissa D. Stuchell‐Brereton, Maxwell I. Zimmerman, Justin J. Miller et al. · Proceedings of the National Academy of Sciences · 2023 · 40 citations · Full text

Drug specificity and affinity are encoded in the probability of cryptic pocket opening in myosin motor domains

Artur Meller, Jeffrey M. Lotthammer, Louis G. Smith et al. · eLife · 2023 · 34 citations · Full text

Chemically Accurate Relative Folding Stability of RNA Hairpins from Molecular Simulations

Louis G. Smith, Zhen Tan, Aleksandar Spasic et al. · Journal of Chemical Theory and Computation · 2018 · 23 citations · Full text

SGLT2 inhibitors activate pantothenate kinase in the human heart

Nicholas Forelli, Deborah Eaton, Jiten Patel et al. · 2024 · 12 citations · Full text

PopShift: A Thermodynamically Sound Approach to Estimate Binding Free Energies by Accounting for Ligand-Induced Population Shifts from a Ligand-Free Markov State Model

Louis G. Smith, Borna Novak, Meghan Osato et al. · Journal of Chemical Theory and Computation · 2024 · 11 citations · Full text