Search found 1 match

by Jim S.
Thu Jan 04, 2024 6:12 am
Forum: OpenMM
Topic: rosetta-like structure and residue scores?
Replies: 1
Views: 769

rosetta-like structure and residue scores?

Dear Team, thanks for the fantastic work with OpenMM. I come from using OpenMM through the popular toolboxes build around AlphaFold / ColabFold and have a probably simple question. In rosetta I can use the relaxation protocol to derive scores for the structure (total score, attraction, vdw, repulsio...