Articles with public access mandates - Angela N. MiguesLearn more
Available somewhere: 3
ff19SB: amino-acid-specific protein backbone parameters trained against quantum mechanics energy surfaces in solution
C Tian, K Kasavajhala, KAA Belfon, L Raguette, H Huang, AN Migues, ...
Journal of chemical theory and computation 16 (1), 528-552, 2019
Mandates: US National Science Foundation, US Department of Energy, US National …
On the rational design of zeolite clusters
AN Migues, A Muskat, SM Auerbach, W Sherman, S Vaitheeswaran
ACS Catalysis 5 (5), 2859-2865, 2015
Mandates: US Department of Energy
On the rational design of zeolite clusters for converging reaction barriers: Quantum study of aldol kinetics confined in HZSM-5
AN Migues, Q Sun, S Vaitheeswaran, W Sherman, SM Auerbach
The Journal of Physical Chemistry C 122 (40), 23230-23241, 2018
Mandates: US National Science Foundation
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