Jenke Scheen

Publication Activity (10 Years)

Years Active: 2020-2023
Publications (10 Years): 2

Top Topics

Statistical Methods

Energy Minimization

Posterior Distribution

Top Venues

J. Chem. Inf. Model.

Publications

Yuanqing Wang, Iván Pulido, Kenichiro Takaba, Benjamin Kaminow, Jenke Scheen, Lily Wang, John D. Chodera
EspalomaCharge: Machine learning-enabled ultra-fast partial charge assignment. CoRR (2023)
Jenke Scheen, Wilson Wu, Antonia S. J. S. Mey, Paolo Tosco, Mark Mackey, Julien Michel
Hybrid Alchemical Free Energy/Machine-Learning Methodology for the Computation of Hydration Free Energies. J. Chem. Inf. Model. 60 (11) (2020)