Austin Weigle
Austin Weigle
ORISE USDA-ARS SCINet/AI-CoE Postdoctoral Fellow
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Extensive CRISPR RNA modification reveals chemical compatibility and structure-activity relationships for Cas9 biochemical activity
D O’Reilly, ZJ Kartje, EA Ageely, E Malek-Adamian, M Habibian, ...
Nucleic Acids Research 47 (2), 546-558, 2019
Cross-talk of cannabinoid and endocannabinoid metabolism is mediated via human cardiac CYP2J2
WR Arnold, AT Weigle, A Das
Journal of inorganic biochemistry 184, 88-99, 2018
CYP2J2 molecular recognition: a new axis for therapeutic design
A Das, AT Weigle, WR Arnold, JS Kim, LN Carnevale, HC Huff
Pharmacology & therapeutics 215, 107601, 2020
Orthology‐based analysis helps map evolutionary diversification and predict substrate class use of BAHD acyltransferases
LH Kruse, AT Weigle, M Irfan, J Martínez‐Gómez, JD Chobirko, ...
The Plant Journal 111 (5), 1453-1468, 2022
Impact of increased membrane realism on conformational sampling of proteins
AT Weigle, M Carr, D Shukla
Journal of Chemical Theory and Computation 17 (8), 5342-5357, 2021
Thirty years of molecular dynamics simulations on posttranslational modifications of proteins
AT Weigle, J Feng, D Shukla
Physical Chemistry Chemical Physics 24 (43), 26371-26397, 2022
The Arabidopsis AtSWEET13 transporter discriminates sugars by selective facial and positional substrate recognition
AT Weigle, D Shukla
Communications Biology 7 (1), 764, 2024
Functional regulation of aquaporin dynamics by lipid bilayer composition
ATP Nguyen, AT Weigle, D Shukla
Nature communications 15 (1), 1848, 2024
Deep mutational scanning reveals sequence to function constraints for SWEET family transporters
K Narayanan, AT Weigle, L Xu, X Mi, C Zhang, LQ Chen, E Procko, ...
bioRxiv, 2024.06. 28.601307, 2024
Interplay between phosphorylation and oligomerization tunes the conformational ensemble of SWEET transporters
AT Weigle, D Shukla
bioRxiv, 2024.06. 12.598708, 2024
Data-Driven Design of Selective Partial Agonist for Cannabinoid Receptors
S Dutta, A Weigle, D Shukla
2023 AIChE Annual Meeting, 2023
Elucidating Ligand Selectivity and Partial Agonism Towards Cannabinoid Receptors Using Machine Learning Approaches
S Dutta, B Selvam, A Weigle, D Shukla
2022 AIChE Annual Meeting, 2022
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