Skip to content
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

Code on property prediction experiments #2

Open
teslacool opened this issue Sep 27, 2021 · 1 comment
Open

Code on property prediction experiments #2

teslacool opened this issue Sep 27, 2021 · 1 comment

Comments

@teslacool
Copy link

I failed to use Psi4 to reproduce the Property Prediction experiments and the results are very different in the order of magnitude. Can you release the code for property prediction experiments and the randomly selected 30 molecule smiles?
@shichence
Copy link
Collaborator

Yeah, we have the uncleaned code for the Property Prediction part. We will release that soon.

Sign up for free to join this conversation on GitHub. Already have an account? Sign in to comment
Assignees
No one assigned
Labels
None yet
Projects
None yet
Milestone
No milestone
Development

No branches or pull requests
2 participants
@shichence @teslacool