Negin Forouzesh

8PUBLICATIONS
4CO-AUTHORS
Theoretical quantum chemistryStatistical mechanics in chemistryComputational chemistryBioinformatic methods developmentBiomolecular modelling and design
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Publications (8)

|Aug 27, 2026
Multi-Objective Loss Function For Free Energy Calculations.

|Dec 10, 2024
Optimal Dielectric Boundary for Binding Free Energy Estimates in the Implicit Solvent.

Negin Forouzesh, Fatemeh Ghafouri, Igor S Tolokh

|Dec 27, 2023
Improving the Accuracy of Physics-Based Hydration-Free Energy Predictions by Machine Learning the Remaining Error Relative to the Experiment.

Lewis Bass, Luke H Elder, Dan E Folescu

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