Evolution of the SARS‐CoV‐2 proteome in three dimensions (3D) during the first 6 months of the COVID‐19 pandemic JH Lubin, C Zardecki, EM Dolan, C Lu, Z Shen, S Dutta, JD Westbrook, ... Proteins: Structure, Function, and Bioinformatics 90 (5), 1054-1080, 2022 | 50 | 2022 |
RNA electrostatics: how ribozymes engineer active sites to enable catalysis S Ekesan, E McCarthy, DA Case, DM York The Journal of Physical Chemistry B 126 (32), 5982-5990, 2022 | 9 | 2022 |
Catalytic mechanism and pH dependence of a methyltransferase ribozyme (MTR1) from computational enzymology E McCarthy, Ş Ekesan, TJ Giese, TJ Wilson, J Deng, L Huang, DMJ Lilley, ... Nucleic acids research 51 (9), 4508-4518, 2023 | 6 | 2023 |
Authenticity in Culture, Self, and Society ED McCarthy, JP Williams, P Vannini Ashgate, 2009 | 6 | 2009 |
Dissociative transition state in hepatitis delta virus ribozyme catalysis B Weissman, S Ekesan, HC Lin, S Gardezi, NS Li, TJ Giese, E McCarthy, ... Journal of the American Chemical Society 145 (5), 2830-2839, 2023 | 4 | 2023 |
Surface-accelerated string method for locating minimum free energy paths TJ Giese, S Ekesan, E McCarthy, Y Tao, DM York Journal of Chemical Theory and Computation 20 (5), 2058-2073, 2024 | 3 | 2024 |
Software Infrastructure for Next-Generation QM/MM− ΔMLP Force Fields TJ Giese, J Zeng, L Lerew, E McCarthy, Y Tao, S Ekesan, DM York The Journal of Physical Chemistry B, 2024 | 1 | 2024 |
Evolution of the SARS-CoV-2 proteome in three dimensions (3D) during the first six months of the COVID-19 pandemic Short Title: Early 3D Evolution of the SARS-CoV-2 proteome JH Lubin, C Zardecki, EM Dolan, C Lu, Z Shen, S Dutta, JD Westbrook, ... | | |