NVIDIA/cheminformatics
Facilitates searching, screening, and organizing large chemical databases
Jupyter Notebook
Issues
- 1
- 0
GPG Key Rotation Breaking First Build
#163 opened by lilleswing - 0
Molecular embedding
#161 opened by ethancohen123 - 0
smiletoembedding get the last embedding
#159 opened by leoin841023 - 8
Unable to use megamolbart model
#147 opened by muammar - 2
test_megamolbart.py not working
#154 opened by mircare - 1
./launch.sh config assumes /bin/bash
#146 opened by muammar - 1
Failed to run cuchemUI container - "ImportError: cannot import name 'get_current_traceback' from 'werkzeug.debug.tbtools' "
#152 opened by ksasagit - 2
docker build fails
#79 opened by ARekesh