Batista, Victor S.
4469  Ergebnisse:
Personensuche X
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4

ChemSpaceAL: An Efficient Active Learning Methodology Appli..:

Kyro, Gregory W. ; Morgunov, Anton ; Brent, Rafael I..
Journal of Chemical Information and Modeling.  64 (2024)  3 - p. 653-665 , 2024
 
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8

Quantum-to-Classical Neural Network Transfer Learning Appli..:

Smaldone, Anthony M. ; Batista, Victor S.
Journal of Chemical Theory and Computation.  20 (2024)  11 - p. 4901-4908 , 2024
 
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9

Water Ligands Regulate the Redox Leveling Mechanism of the ..:

Liu, Jinchan ; Yang, Ke R. ; Long, Zhuoran...
Journal of the American Chemical Society.  146 (2024)  23 - p. 15986-15999 , 2024
 
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12

Occupancy Analysis of Water Molecules inside Channels withi..:

Kaur, Divya ; Reiss, Krystle ; Wang, Jimin...
The Journal of Physical Chemistry B.  128 (2024)  10 - p. 2236-2248 , 2024
 
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13

Mutation-induced shift of the photosystem II active site re..:

Flesher, David A. ; Liu, Jinchan ; Wang, Jimin...
Journal of Biological Chemistry.  300 (2024)  7 - p. 107475 , 2024
 
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15

Breaking a Molecular Scaling Relationship Using an Iron–Iro..:

Nishiori, Daiki ; Menzel, Jan Paul ; Armada, Nicholas...
Journal of the American Chemical Society.  146 (2024)  17 - p. 11622-11633 , 2024
 
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