C. David Sherrill
Active 1998–2025
- 65
- Papers
- 21,421
- Citations
- 47
- h-index
- 60
- i10-index
Citations
Citation sources
Countries
Institutions
Fields
- Physics and Astronomy19.9%
- Biochemistry, Genetics and Molecular Biology17.8%
- Chemistry17.8%
- Materials Science15.5%
- Computer Science14%
- Medicine5.5%
- Other9.5%
Topics
- Advanced Chemical Physics Studies8.4%
- Computational Drug Discovery Methods5.8%
- Protein Structure and Dynamics5.8%
- Machine Learning in Materials Science5.5%
- Spectroscopy and Quantum Chemical Studies5%
- Crystallography and molecular interactions4.8%
- Other64.7%
Coauthors
- Edward G. Hohenstein17
- Lori A. Burns12
- Robert M. Parrish9
- Daniel L. Cheney8
- Asem Alenaizan7
- Henry F. Schaefer7
- Zachary L. Glick7
- Daniel G. A. Smith6
- Derek P. Metcalf6
- Michael S. Marshall6
- Mutasem Omar Sinnokrot6
- Steven A. Spronk6
- Alexios Koutsoukas5
- Andrew C. Simmonett5
- A. Eugene DePrince4
- Anna I. Krylov4
- Edward F. C. Byrd4
- Edward F. Valeev4
- Jeffrey B. Schriber4
- Justin M. Turney4
- Konrad Patkowski4
- Matthew L. Leininger4
- Rollin A. King4
- T. Daniel Crawford4
All papers
- P SI4 1.4: Open-source software for high-throughput quantum chemistry
Authors: Daniel G. A. Smith, Lori A. Burns, Andrew C. Simmonett, Robert M. Parrish, Matthew Cole Schieber, Raimondas Galvelis, Peter Kraus, Holger Kruse, Roberto Di Remigio, Asem Alenaizan, Andrew M. James, Susi Lehtola, Jonathon P. Misiewicz, Maximilian Scheurer, Robert A. Shaw, Jeffrey B. Schriber, Yi Xie, Zachary L. Glick, Dominic A. Sirianni, Joseph O'Brien, Jonathan M. Waldrop, Ashutosh Kumar, Edward G. Hohenstein, Benjamin P. Pritchard, Bernard R. Brooks, Henry F. Schaefer, Alexander Yu. Sokolov, Konrad Patkowski, A. Eugene DePrince, Uğur Bozkaya, Rollin A. King, Francesco A. Evangelista, Justin M. Turney, T. Daniel Crawford, C. David Sherrill - The Journal of Chemical Physics 2020 cited by 1,001
- Advances in methods and algorithms in a modern quantum chemistry program package
Authors: Yihan Shao, Laszlo Fusti Molnar, Yousung Jung, Jörg Kußmann, Christian Ochsenfeld, Shawn T. Brown, Andrew T. B. Gilbert, Lyudmila V. Slipchenko, Sergey V. Levchenko, D.P. O'Neill, Robert A. DiStasio, Rohini C. Lochan, Tao Wang, Gregory J. O. Beran, Nicholas A. Besley, John M. Herbert, Ching Yeh Lin, Troy Van Voorhis, Siu Hung Chien, Alexander J. Sodt, Ryan P. Steele, Vitaly A. Rassolov, Paul E. Maslen, Prakashan Korambath, Ross D. Adamson, Brian Austin, Jon Baker, Edward F. C. Byrd, Holger Dachsel, Robert J. Doerksen, Andreas Dreuw, Barry D. Dunietz, Anthony D. Dutoi, Thomas R. Furlani, Steven R. Gwaltney, Andreas Heyden, So Hirata, Chao‐Ping Hsu, Gary S. Kedziora, Rustam Z. Khalliulin, Phil Klunzinger, Aaron M. Lee, Michael S. Lee, WanZhen Liang, Itay Lotan, Nikhil U. Nair, Baron Peters, Emil Proynov, Piotr A. Pieniazek, Young Min Rhee, Jim Ritchie, Edina Rosta, C. David Sherrill, Andrew C. Simmonett, Joseph E. Subotnik, H. Lee Woodcock, Wei-Min Zhang, Alexis T. Bell, Arup K. Chakraborty, Daniel M. Chipman, Frerich J. Keil, Arieh Warshel, Warren J. Hehre, Henry F. Schaefer, Jing Kong, Anna I. Krylov, Peter M. W. Gill, Martin Head‐Gordon - Physical Chemistry Chemical Physics 2006 cited by 2,800
- Psi4 1.1: An Open-Source Electronic Structure Program Emphasizing Automation, Advanced Libraries, and Interoperability
Authors: Robert M. Parrish, Lori A. Burns, Daniel G. A. Smith, Andrew C. Simmonett, A. Eugene DePrince, Edward G. Hohenstein, Uğur Bozkaya, Alexander Yu. Sokolov, Roberto Di Remigio, Ryan M. Richard, Jérôme F. Gonthier, Andrew M. James, Harley R. McAlexander, Ashutosh Kumar, Masaaki Saitow, Xiao Wang, Benjamin P. Pritchard, Prakash Verma, Henry F. Schaefer, Konrad Patkowski, Rollin A. King, Edward F. Valeev, Francesco A. Evangelista, Justin M. Turney, T. Daniel Crawford, C. David Sherrill - Journal of Chemical Theory and Computation 2017 cited by 1,245
- Levels of symmetry adapted perturbation theory (SAPT). I. Efficiency and performance for interaction energies
Authors: Trent M. Parker, Lori A. Burns, Robert M. Parrish, Alden G. Ryno, C. David Sherrill - The Journal of Chemical Physics 2014 cited by 904
- Assessment of the Performance of the M05−2X and M06−2X Exchange-Correlation Functionals for Noncovalent Interactions in Biomolecules
Authors: Edward G. Hohenstein, Samuel T. Chill, C. David Sherrill - Journal of Chemical Theory and Computation 2008 cited by 898
- Psi4: an open‐source ab initio electronic structure program
Authors: Justin M. Turney, Andrew C. Simmonett, Robert M. Parrish, Edward G. Hohenstein, Francesco A. Evangelista, Justin T. Fermann, Benjamin Mintz, Lori A. Burns, Jeremiah J Wilke, Micah L. Abrams, Nicholas J. Russ, Matthew L. Leininger, Curtis L. Janssen, Edward T. Seidl, Wesley D. Allen, Henry F. Schaefer, Rollin A. King, Edward F. Valeev, C. David Sherrill, T. Daniel Crawford - Wiley Interdisciplinary Reviews Computational Molecular Science 2011 cited by 1,076
- The BioFragment Database (BFDb): An open-data platform for computational chemistry analysis of noncovalent interactions
Authors: Lori A. Burns, John C. Faver, Zheng Zheng, Michael S. Marshall, Daniel G. A. Smith, Kenno Vanommeslaeghe, Alexander D. MacKerell, Kenneth M. Merz, C. David Sherrill - The Journal of Chemical Physics 2017 cited by 134
- AP-Net: An Atomic-Pairwise Neural Network for Smooth and Transferable Interaction Potentials
Authors: Zachary L. Glick, Derek P. Metcalf, Alexios Koutsoukas, Steven A. Spronk, Daniel L. Cheney, C. David Sherrill - The Journal of Chemical Physics 2020 cited by 72
- Wavefunction methods for noncovalent interactions
Authors: Edward G. Hohenstein, C. David Sherrill - Wiley Interdisciplinary Reviews Computational Molecular Science 2011 cited by 481
- Energy Component Analysis of π Interactions
Authors: C. David Sherrill - Accounts of Chemical Research 2012 cited by 377
- Revised Damping Parameters for the D3 Dispersion Correction to Density Functional Theory
Authors: Daniel G. A. Smith, Lori A. Burns, Konrad Patkowski, C. David Sherrill - The Journal of Physical Chemistry Letters 2016 cited by 553
- Quantum Chemistry Common Driver and Databases (QCDB) and Quantum Chemistry Engine (QCEngine): Automation and interoperability among computational chemistry programs
Authors: Daniel G. A. Smith, Annabelle Lolinco, Zachary L. Glick, Jiyoung Lee, Asem Alenaizan, Taylor Barnes, Carlos H. Borca, Roberto Di Remigio, David Dotson, Sebastian Ehlert, Alexander G. Heide, Michael F. Herbst, Jan Hermann, Colton B. Hicks, Joshua T. Horton, Adrian G. Hurtado, Peter Kraus, Holger Kruse, Sebastian J. R. Lee, Jonathon P. Misiewicz, Levi N. Naden, Farhad Ramezanghorbani, Maximilian Scheurer, Jeffrey B. Schriber, Andrew C. Simmonett, Johannes Steinmetzer, Jeffrey Wagner, Logan Ward, Matthew Welborn, Doaa Altarawy, Jamshed Anwar, John D. Chodera, Andreas Dreuw, Heather J. Kulik, Fang Liu, Todd J. Martı́nez, Devin A. Matthews, Henry F. Schaefer, Jiřı́ Šponer, Justin M. Turney, Lee‐Ping Wang, Nuwan De Silva, Rollin A. King, John F. Stanton, Mark S. Gordon, Theresa L. Windus, C. David Sherrill, Lori A. Burns - The Journal of Chemical Physics 2021 cited by 45
- The Configuration Interaction Method: Advances in Highly Correlated Approaches
Authors: C. David Sherrill, Henry F. Schaefer - Advances in quantum chemistry 1999 cited by 441
- Density fitting of intramonomer correlation effects in symmetry-adapted perturbation theory
Authors: Edward G. Hohenstein, C. David Sherrill - The Journal of Chemical Physics 2010 cited by 310
- Chemical Assignment of Symmetry-Adapted Perturbation Theory Interaction Energy Components: The Functional-Group SAPT Partition
Authors: Robert M. Parrish, Trent M. Parker, C. David Sherrill - Journal of Chemical Theory and Computation 2014 cited by 152
- Tensor hypercontraction. II. Least-squares renormalization
Authors: Robert M. Parrish, Edward G. Hohenstein, Todd J. Martı́nez, C. David Sherrill - The Journal of Chemical Physics 2012 cited by 239
- Estimates of the Ab Initio Limit for π−π Interactions: The Benzene Dimer
Authors: Mutasem Omar Sinnokrot, Edward F. Valeev, C. David Sherrill - Journal of the American Chemical Society 2002 cited by 1,313
- Substituent Effects in π−π Interactions: Sandwich and T-Shaped Configurations
Authors: Mutasem Omar Sinnokrot, C. David Sherrill - Journal of the American Chemical Society 2004 cited by 678
- Models of S/π interactions in protein structures: Comparison of the H2S–benzene complex with PDB data
Authors: Ashley Ringer McDonald, Anastasia Senenko, C. David Sherrill - Protein Science 2007 cited by 194
- Electronic structure software
Authors: C. David Sherrill, David E. Manolopoulos, Todd J. Martı́nez, Angelos Michaelides - The Journal of Chemical Physics 2020 cited by 60
- Electron-Passing Neural Networks for Atomic Charge Prediction in Systems with Arbitrary Molecular Charge
Authors: Derek P. Metcalf, Andy Jiang, Steven A. Spronk, Daniel L. Cheney, C. David Sherrill - Journal of Chemical Information and Modeling, J. Chem. Inf. Model. 2020 cited by 40
- Density-functional approaches to noncovalent interactions: A comparison of dispersion corrections (DFT-D), exchange-hole dipole moment (XDM) theory, and specialized functionals
Authors: Lori A. Burns, Álvaro Vázquez Mayagoitia, Bobby G. Sumpter, C. David Sherrill - The Journal of Chemical Physics 2011 cited by 732
- Density fitting and Cholesky decomposition approximations in symmetry-adapted perturbation theory: Implementation and application to probe the nature of π-π interactions in linear acenes
Authors: Edward G. Hohenstein, C. David Sherrill - The Journal of Chemical Physics 2010 cited by 347
- Python implementation of the restrained electrostatic potential charge model
Authors: Asem Alenaizan, Lori A. Burns, C. David Sherrill - International Journal of Quantum Chemistry 2019 cited by 48
