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On baseline models (SchNet, DimeNet, CGCNN)
|
|
8
|
2103
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July 18, 2021
|
|
How big is NeurIPS Challenge's Data going to be?
|
|
1
|
699
|
June 17, 2021
|
|
How many members can be in a team?
|
|
1
|
608
|
June 18, 2021
|
|
Neurips 2020's Competition timeline
|
|
2
|
681
|
June 17, 2021
|
|
Leaderboard ranking
|
|
1
|
621
|
June 8, 2021
|
|
Periodic boundary conditions with vacuum?
|
|
4
|
1268
|
May 25, 2021
|
|
What is the uncertainty of the DFT data?
|
|
1
|
713
|
April 16, 2021
|
|
What's the training loss (as opposed to validation loss) like?
|
|
2
|
700
|
April 7, 2021
|
|
Setting up multi-GPUs in the notebook
|
|
2
|
1470
|
March 18, 2021
|
|
Vasp input file
|
|
2
|
1092
|
March 2, 2021
|
|
Evaluation server and leaderboards are now up!
|
|
0
|
741
|
March 1, 2021
|
|
Clarification questions about `sid` field
|
|
5
|
886
|
February 26, 2021
|
|
Constructing Graphs from Catalyst-Adsorbate Systems
|
|
2
|
926
|
February 15, 2021
|
|
Leaderboard delayed a week
|
|
0
|
587
|
February 9, 2021
|
|
Leaderboard coming Feb. 9th
|
|
2
|
623
|
February 9, 2021
|
|
Accessing the .cif structure files from the dataset
|
|
1
|
870
|
January 18, 2021
|