Rudramani Pokhrel

Results 2 issues of Rudramani Pokhrel

Hi Arne, Every time I run generate_ligands.py script, I get babel error: *** Open Babel Error in TetStereoToWedgeHash Failed to set stereochemistry as unable to find an available bond. Though...

Hi Arne, thanks for this excellent work. I plan to replace Autogrow with your model in one of my SBDD pipelines. However, in the module constants.py, I found that, for...