Carlos X. Hernández

MDTraj: A Modern Open Library for the Analysis of Molecular Dynamics Trajectories

Robert T. McGibbon, Kyle A. Beauchamp, Matthew P. Harrigan et al. · Biophysical Journal · 2015 · 2.4K citations · Full text

Engineering, Modern Open Library, Computational Biology +8

MSMBuilder: Statistical Models for Biomolecular Dynamics

Matthew P. Harrigan, Mohammad M. Sultan, Carlos X. Hernández et al. · Biophysical Journal · 2017 · 290 citations · Full text

Biophysical Modeling, Systems Biology, Engineering +4

Variational encoding of complex dynamics

Carlos X. Hernández, Hannah K. Wayment-Steele, Mohammad M. Sultan et al. · Physical review. E · 2018 · 181 citations · Full text

Geometric Learning, Engineering, Machine Learning +18

MDTraj: a modern, open library for the analysis of molecular dynamics trajectories

Robert T. McGibbon, Kyle A. Beauchamp, Christian R. Schwantes et al. · 2014 · 48 citations · Full text

Engineering, Molecular Biology, Molecular Dynamics Trajectories +16

Osprey: Hyperparameter Optimization for Machine Learning

Robert T. McGibbon, Carlos X. Hernández, Matthew P. Harrigan et al. · The Journal of Open Source Software · 2016 · 40 citations · Full text

Hyperparameter Optimization, Hyperparameter Estimation, Engineering +6