Anastasia Saar

Publication Activity (10 Years)

Years Active: 2023-2023
Publications (10 Years): 3

Top Topics

Protein Protein Interactions

Linear Support Vector Machines

Top Venues

J. Chem. Inf. Model.

Publications

Anastasia Saar, Mohammad Mehdi Ghahremanpour, Julian Tirado-Rives, William L. Jorgensen
Assessing Metadynamics and Docking for Absolute Binding Free Energy Calculations Using Severe Acute Respiratory Syndrome Coronavirus 2 Main Protease Inhibitors. J. Chem. Inf. Model. 63 (22) (2023)
Mohammad Mehdi Ghahremanpour, Anastasia Saar, Julian Tirado-Rives, William L. Jorgensen
Computation of Absolute Binding Free Energies for Noncovalent Inhibitors with SARS-CoV-2 Main Protease. J. Chem. Inf. Model. 63 (16) (2023)
Mohammad Mehdi Ghahremanpour, Anastasia Saar, Julian Tirado-Rives, William L. Jorgensen
Ensemble Geometric Deep Learning of Aqueous Solubility. J. Chem. Inf. Model. 63 (23) (2023)