Micholas Dean Smith - researchr alias

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Viewing Publication 1 - 4 from 4

2025

Exploring Peptide's Antifreeze Activity Using a Semi-Automated Molecular Dynamics-Enabled Screening FrameworkYuan Yuan, Micholas Dean Smith, Vermont P. Dia, Tong Wang. jcisd, 65(19):9831-9841, 2025. [doi]

2021

Supercomputing Pipelines Search for Therapeutics Against COVID-19Josh Vincent Vermaas, Ada Sedova, Matthew B. Baker, Swen Boehm, David M. Rogers, Jeff Larkin, Jens Glaser, Micholas Dean Smith, Oscar R. Hernandez, Jeremy C. Smith. cse, 23(1):7-16, 2021. [doi]

2020

Supercomputer-Based Ensemble Docking Drug Discovery Pipeline with Application to Covid-19A. Acharya, Rupesh Agarwal, Matthew B. Baker, Jérôme Baudry, Debsindhu Bhowmik, Swen Böhm, K. G. Byler, S. Y. Chen, Leighton Coates, C. J. Cooper, O. Demerdash, Isabella Daidone, John D. Eblen, Sally R. Ellingson, Stefano Forli, J. Glaser, James C. Gumbart, J. Gunnels, Oscar R. Hernandez, Stephan Irle, D. W. Kneller, A. Kovalevsky, Jeffrey M. Larkin, T. J. Lawrence, Scott Legrand, S.-H. Liu, J. C. Mitchell, G. Park, Jerry M. Parks, Anna Pavlova, Loukas Petridis, Duncan Poole, L. Pouchard, A. Ramanathan, D. M. Rogers, Diogo Santos-Martins, Aaron Scheinberg, Ada Sedova, Y. Shen, Jeremy C. Smith, Micholas Dean Smith, C. Soto, A. Tsaris, Mathialakan Thavappiragasam, Andreas F. Tillack, Josh V. Vermaas, V. Q. Vuong, J. Yin, S. Yoo, M. Zahran, Laura Zanetti Polzi. jcisd, 60(12):5832-5852, 2020. [doi]

2015

21-30: A Comparison of OPLS, AMBER, CHARMM, and GROMOS Force FieldsMicholas Dean Smith, J. Srinivasa Rao, Elizabeth Segelken, Luis Cruz. jcisd, 55(12):2587-2595, 2015. [doi]

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