Highly Accurate and Fast Prediction of MOF Free Energy via Machine Learning
A
Andre Niyongabo Rubungo
(Department of Computer Science)
F
Fernando Fajardo-Rojas
(Department of Chemical and Biological Engineering)
D
Diego A. Gómez-Gualdrón
(Department of Chemical and Biological Engineering)
A
Adji Bousso Dieng
(Department of Computer Science)
Article Details
Volume / Issue
Vol. 147, Issue 52
Published
December 31, 2025
Pages
48035-48045
ISSN
0002-7863
Publisher
American Chemical Society
Journal Info
Journal of the American Chemical Society
American Chemical Society
ISSN: 0002-7863 Physical Sciences
Authors (4)
A
Andre Niyongabo Rubungo
Department of Computer Science
F
Fernando Fajardo-Rojas
Department of Chemical and Biological Engineering
D
Diego A. Gómez-Gualdrón
Department of Chemical and Biological Engineering
A
Adji Bousso Dieng
Department of Computer Science
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