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ORCIDC. David Sherrill
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- affiliation: Georgia Institute of Technology, Atlanta GA, USA
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2020 – today
- 2024
[j6]Derek P. Metcalf
, Zachary L. Glick, Andrea Bortolato, Andy Jiang, Daniel L. Cheney, C. David Sherrill:
Directional ΔG Neural Network (DrΔG-Net): A Modular Neural Network Approach to Binding Free Energy Prediction. J. Chem. Inf. Model. 64(6): 1907-1918 (2024)- 2023
- [j5]Rameshwar L. Kumawat, C. David Sherrill:
High-Order Quantum-Mechanical Analysis of Hydrogen Bonding in Hachimoji and Natural DNA Base Pairs. J. Chem. Inf. Model. 63(10): 3150-3157 (2023) - 2021
- [j4]Derek P. Metcalf, Andy Jiang, Steven A. Spronk, Daniel L. Cheney, C. David Sherrill:
Electron-Passing Neural Networks for Atomic Charge Prediction in Systems with Arbitrary Molecular Charge. J. Chem. Inf. Model. 61(1): 115-122 (2021)
2000 – 2009
- 2009
- [j3]C. David Sherrill, Bobby G. Sumpter, Mutasem O. Sinnokrot, Michael S. Marshall, Edward G. Hohenstein, Ross C. Walker, Ian R. Gould:
Assessment of standard force field models against high-quality ab initio potential curves for prototypes of pi-pi, CH/pi, and SH/pi interactions. J. Comput. Chem. 30(14): 2187-2193 (2009) - 2007
- [j2]T. Daniel Crawford, C. David Sherrill, Edward F. Valeev, Justin T. Fermann, Rollin A. King, Matthew L. Leininger, Shawn T. Brown, Curtis L. Janssen, Edward T. Seidl, Joseph P. Kenny, Wesley D. Allen:
PSI3: An open-source Ab Initio electronic structure package. J. Comput. Chem. 28(9): 1610-1616 (2007) - 2001
- [j1]Matthew L. Leininger, C. David Sherrill, Wesley D. Allen, Henry F. Schaefer III:
Systematic Study of Selected Diagonalization Methods for Configuration Interaction Matrices. J. Comput. Chem. 22(13): 1574-1589 (2001)
Coauthor Index
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