Stefan Boresch
机构:Institute of Applied Physics, University of Vienna, TU Wien, Computational Physics (United States), Institute of Applied Physics and Computational Mathematics · ORCID:0000-0002-2793-6656
发表论文 100 篇 · 总被引 13399 次 · h-index 37
代表论文
- CHARMM at 45: Enhancements in Accessibility, Functionality, and Speed (2024 · The Journal of Physical Chemistry B · 被引 135)
- Insights and Challenges in Correcting Force Field Based Solvation Free Energies Using a Neural Network Potential (2024 · The Journal of Physical Chemistry B · 被引 18)
- Reweighting from Molecular Mechanics Force Fields to the ANI-2x Neural Network Potential (2024 · Journal of Chemical Theory and Computation · 被引 16)
- On Analytical Corrections for Restraints in Absolute Binding Free Energy Calculations (2024 · Journal of Chemical Information and Modeling · 被引 14)
- Transferable Neural Network Potentials and Condensed Phase Properties (2025 · Journal of Chemical Information and Modeling · 被引 8)
- Optimizing Absolute Binding Free Energy Calculations for Production Usage (2025 · Journal of Chemical Theory and Computation · 被引 8)