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2010.09990
Cited By
The Open Catalyst 2020 (OC20) Dataset and Community Challenges
20 October 2020
L. Chanussot
Abhishek Das
Siddharth Goyal
Thibaut Lavril
Muhammed Shuaibi
M. Rivière
Kevin Tran
Javier Heras-Domingo
Caleb Ho
Weihua Hu
Aini Palizhati
Anuroop Sriram
Brandon M. Wood
Junwoong Yoon
Devi Parikh
C. L. Zitnick
Zachary W. Ulissi
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Papers citing
"The Open Catalyst 2020 (OC20) Dataset and Community Challenges"
5 / 5 papers shown
Title
Transition States Energies from Machine Learning: An Application to Reverse Water-Gas Shift on Single-Atom Alloys
Raffaele Cheula
Mie Andersen
14
0
0
01 May 2025
Towards Faster and More Compact Foundation Models for Molecular Property Prediction
Yasir Ghunaim
Andrés Villa
Gergo Ignacz
Gyorgy Szekely
Motasem Alfarra
Bernard Ghanem
AI4CE
59
41
0
28 Apr 2025
Physics-Informed Weakly Supervised Learning for Interatomic Potentials
Makoto Takamoto
Viktor Zaverkin
Mathias Niepert
AI4CE
22
0
0
23 Jul 2024
Guided Multi-objective Generative AI to Enhance Structure-based Drug Design
Amit Kadan
Kevin Ryczko
Erika Lloyd
A. Roitberg
Takeshi Yamazaki
33
0
0
20 May 2024
Machine Learning in Thermodynamics: Prediction of Activity Coefficients by Matrix Completion
F. Jirasek
Rodrigo Alves
J. Damay
Robert A. Vandermeulen
Robert Bamler
Michael Bortz
Stephan Mandt
Marius Kloft
Hans Hasse
129
58
0
29 Jan 2020
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