HannesStark/FlowSite
Implementation of FlowSite and HarmonicFlow from the paper "Harmonic Self-Conditioned Flow Matching for Multi-Ligand Docking and Binding Site Design"
PythonMIT
Issues
- 1
pocket_residue_cutoff needed to run examples
#7 opened by MKCarter - 1
Not an issue but is there a way to output sidechain conformation to visualize the prediction?
#4 opened by bio-rat - 1
- 6
error when loading model
#5 opened by zhouxiangxin1998 - 6
Issues with the options --wandb, --ns 48 --nv 12, and with the GPU version of torch
#3 opened by orli91 - 0
About the processed data
#2 opened by zhouxiangxin1998