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Sarah Sirin
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AB‐bind: antibody binding mutational database for computational affinity predictions
S Sirin, JR Apgar, EM Bennett, AE Keating
Protein Science 25 (2), 393-409, 2016
1492016
A computational approach to enzyme design: Predicting ω-aminotransferase catalytic activity using docking and MM-GBSA scoring
S Sirin, R Kumar, C Martinez, MJ Karmilowicz, P Ghosh, YA Abramov, ...
Journal of chemical information and modeling 54 (8), 2334-2346, 2014
1002014
Aging mechanism of soman inhibited acetylcholinesterase
GS Sirin, Y Zhou, L Lior-Hoffmann, S Wang, Y Zhang
The journal of physical chemistry B 116 (40), 12199-12207, 2012
762012
Physics‐based enzyme design: Predicting binding affinity and catalytic activity
S Sirin, DA Pearlman, W Sherman
Proteins: Structure, Function, and Bioinformatics 82 (12), 3397-3409, 2014
482014
How Is Acetylcholinesterase Phosphonylated by Soman? An Ab Initio QM/MM Molecular Dynamics Study
GS Sirin, Y Zhang
The journal of physical chemistry A 118 (39), 9132-9139, 2014
352014
Mechanistic and Computational Studies on the Reductive Half-Reaction of Tyrosine to Phenylalanine Active Site Variants of D-Arginine Dehydrogenase
S Gannavaram, S Sirin, W Sherman, G Gadda
Biochemistry, 2014
182014
Computational approach to enzyme design
S Sirin, W Sherman
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 249, 2015
2015
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Articles 1–7