v1.6.0
·
281 commits
to main
since this release
- Fixed some bugs relating to
classifyhaving to do with integer input parameters being read as strings. - When finetuning ESM2 you can now change the masking proportion with
--mask_fraction 0.25with the default set to 0.15, which is common in the literature. - Added GeoDock, a deep-learning based method for protein-protein docking
- Full MD simulations can now be done with an input pdb file. This is very experimental, so please let me know your experience and if you run into issues!