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Open Catalyst Challenge (NeurIPS challenge, dead ... (No replies)
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Dear Psi-k community,
Along with Larry Zitnick at Facebook AI Research we are hosting a challenge at NeurIPS to find models that can predict relaxed energies of molecules at catalyst interfaces (which we call IS2RE) using the OC20 dataset. Full details are here: https://opencatalystproject.org/challenge.html . The deadline is October 6th 2021.
I hope that some of you from this community have ideas or approaches that you could develop or submit for this challenge. I am also confident that approaches and strategies developed for this challenge will benefit other catalyst/materials efforts.
There's also a discussion page here: https://discuss.opencatalystproject.org/
Looking forward to seeing what the community comes up with by October!
Zack