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Biorxiv : the Preprint Server for Biology|August 7, 2023
Graph Attention Site Prediction (GrASP): Identifying Druggable Binding Sites Using Graph Neural Networks with AttentionZachary Smith, Michael Strobel, Bodhi P Vani, et al.
The Journal of Chemical Physics|December 24, 2018
Multi-dimensional spectral gap optimization of order parameters (SGOOP) through conditional probability factorizationZachary Smith, Debabrata Pramanik, Sun-Ting Tsai, et al.
Angewandte Chemie (International Ed. in English)|April 29, 2022
Protein Flexibility and Dissociation Pathway Differentiation Can Explain Onset of Resistance Mutations in KinasesMrinal Shekhar, Zachary Smith, Markus A Seeliger, et al.
Journal of Chemical Information and Modeling|March 7, 2024
Graph Attention Site Prediction (GrASP): Identifying Druggable Binding Sites Using Graph Neural Networks with AttentionZachary Smith, Michael Strobel, Bodhi P Vani, et al.
Gastroenterology & Hepatology|August 16, 2016
Assessment of Physicians' Perceived Risk of Inflammatory Bowel Disease Medications in Pregnant PatientsRobert Rhodes, Zachary Smith, Jaymes Adams, et al.
AORN Journal|January 29, 2025
A Comparative Study of Time to Initiate Chest Compressions and Chest Compression Fraction in the Supine and Prone Positions Using SimulationZachary Smith, Darren Sessler, Marilyn H Oermann, et al.
Urology|December 6, 2020
Retzius Sparing Prostatectomy Effect on Symptomatic Lymphocele RatesDaniel Wong, Javier Rincon, Grant Henning, et al.
Annual Review of Physical Chemistry|February 21, 2024
Enhanced Sampling with Machine LearningShams Mehdi, Zachary Smith, Lukas Herron, et al.
The Journal of Chemical Physics|December 23, 2020
Confronting pitfalls of AI-augmented molecular dynamics using statistical physicsShashank Pant, Zachary Smith, Yihang Wang, et al.
The Journal of Physical Chemistry. B|August 26, 2020
Discovering Protein Conformational Flexibility through Artificial-Intelligence-Aided Molecular DynamicsZachary Smith, Pavan Ravindra, Yihang Wang, et al.
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