New issue

Have a question about this project? Sign up for a free GitHub account to open an issue and contact its maintainers and the community.

Sign up for GitHub

By clicking “Sign up for GitHub”, you agree to our terms of service and privacy statement. We’ll occasionally send you account related emails.

Already on GitHub? Sign in to your account

Jump to bottom

consider smi2sdf3d for confgen in molenc_ligprep.sh #119

Open

UnixJunkie opened this issue May 31, 2022 · 0 comments

Assignees

Labels

enhancement prio 02

Owner

UnixJunkie commented May 31, 2022

some rdkit-based script for confgen; https://github.com/UnixJunkie/smi2sdf3d

UnixJunkie added enhancement prio 02 labels

UnixJunkie self-assigned this

Sign up for free to join this conversation on GitHub. Already have an account? Sign in to comment