Dr. Suneel Kumar BVS

icon indicating a website link sbvs.me icon indicating an email [email protected]

icon company Molecular Forecaster icon location Montreal, Canada icon location Director of AI & Drug design in Molecular Forecaster, Montreal, Canada

Results 5 issues of Dr. Suneel Kumar BVS

gpu server launching issue

4 comment

Hi, Im facing issue while issuing gpu server command, please see the below snap for details. Can you please help me out here. ![image](https://user-images.githubusercontent.com/334679/80864827-d5561300-8ca2-11ea-8708-fc8a85d18dd1.png) Regards, Suneel

Regarding Path setup

1 comment

Hi, I have a questions related to path setup in jupyter notebook. I was bit confused with the path definitions : reinventcli folder should redirected to "reinventv.3.1 folder" rather than...

Visualize the models?

5 comment

Hi, Thanks for sharing the script and nice tutorial on how to generate pharmacophore models. Will it be possible to view (pymol or nglview) the generated pharmacophore models for analysis...

Anaconda fails to activate environment on Windows OS

'source' is not recognized as an internal or external command anaconda. source activate deepchem command is not working in windows OS. Any alternate suggestions.

Precomputed docking poses

1 comment

Hi, I really liked the tool. Im trying to import and visualize precomputed docking poses into dockey rather than generating again using autodock?. Is there any option to import precomputed...