Skip to content

Latest commit

 

History

History
4 lines (4 loc) · 351 Bytes

README.md

File metadata and controls

4 lines (4 loc) · 351 Bytes

2Dmodel_path_analysis

Jupyter notebook with 2D test potential energy landscape for performing model biased simulations combined with pathway analysis as describes in S. Wolf, M. Post and G. Stock, Path separation of dissipation-corrected targeted molecular dynamics simulations of protein-ligand unbinding, https://arxiv.org/abs/2212.07154 (2022).