Skip to content

Conversation

@Kh4L
Copy link
Contributor

@Kh4L Kh4L commented Mar 19, 2024

This PR adds OGB LSC example pcqm4m https://ogb.stanford.edu/docs/lsc/pcqm4mv2/ , large scale graph regression: predicting the HOMO-LUMO energy gap in electronvolt (eV) given 2D molecular graphs.

Most of the code is adapted from the https://github.com/snap-stanford/ogb repository.

@Kh4L Kh4L marked this pull request as ready for review March 30, 2024 20:19
@Kh4L Kh4L requested a review from wsad1 as a code owner March 30, 2024 20:19
@puririshi98
Copy link
Contributor

@akihironitta let us know if anything else needed to get this merged?

Copy link
Member

@akihironitta akihironitta left a comment

Choose a reason for hiding this comment

The reason will be displayed to describe this comment to others. Learn more.

This is great!

In df01ea3, I fixed invalid code and simplified the script for readability and hackability by addressing linter errors, removing too verbose efficiency measurements.

LGTM once the CI is green, but feel free to ask Matthias for another review.

@puririshi98 puririshi98 enabled auto-merge (squash) June 26, 2024 19:51
@puririshi98 puririshi98 merged commit 7100e88 into pyg-team:master Jun 26, 2024
Sign up for free to join this conversation on GitHub. Already have an account? Sign in to comment

Projects

None yet

Development

Successfully merging this pull request may close these issues.

4 participants