Skip to content

Graph convolutional networks for partial atomic charges

License

Notifications You must be signed in to change notification settings

choderalab/gcncharge

Folders and files

NameName
Last commit message
Last commit date

Latest commit

 

History

3 Commits
 
 
 
 
 
 

Repository files navigation

Graph convolutional networks for partial atomic charges

Experiments in using graph convolutional networks for determining partial atomic charges of biomolecular systems.

Notebooks

About

Graph convolutional networks for partial atomic charges

Resources

License

Stars

Watchers

Forks

Releases

No releases published

Packages

No packages published