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Dominic Sirianni
Graduate Student
Educational Background
  • B.S. Chemistry, Edinboro University of Pennsylvania, 2015
  • B.S. Mathematics, Edinboro University of Pennsylvania, 2015
  • Presidential Fellow, Georgia Tech
  • Honorable Mention, 2015 NSF Graduate Research Fellowship Program
Research Interests
  • Ab initio force field development
  • Ab initio drug design
  • Non-covalent interactions in biochemical systems
Representative Publications

``Tipping the Balance Between S-π and O-π Interactions,'' J. Hwang, P. Li, M. D. Smith, C. E. Warden, D. A. Sirianni, E. C. Vik, J. M. Maier, C. J. Yehl, C. D. Sherrill, and K. D. Shimizu, J. Am. Chem. Soc. 140, 13301-13307 (2018) (doi: 10.1021/jacs.8b07617)

`` PSI4NUMPY: An Interactive Quantum Chemistry Programming Environment for Reference Implementations and Rapid Development,'' D. G. A. Smith, L. A. Burns, D. A. Sirianni, D. R. Nascimento, A. Kumar, A. M. James, J. B. Schriber, T. Zhang, B. Zhang, A. S. Abbott, E. J. Berquist, M. H. Lechner, L. A. Cunha, A. G. Heide, J. M. Waldrop, T. Y. Takeshita, A. Alenaizan, D. Neuhauser, R. A. King, A. C. Simmonett, J. M. Turney, H. F. Schaefer, F. A. Evangelista, A. E. DePrince, T. D. Crawford, K. Patkowski, and C. D. Sherrill, J. Chem. Theory Comput. 14, 3504-3511 (2018) (doi: 10.1021/acs.jctc.8b00286)

``Assessment of Density Functional Methods for Geometry Optimization of Biomolecular Van Der Waals Complexes,'' D. A. Sirianni, A. Alenaizan, D. L. Cheney, and C. D. Sherrill, J. Chem. Theory Comput. 14, 3004-3013 (2018) (doi: 10.1021/acs.jctc.8b00114)

``Comparison of Explicitly Correlated Methods for Computing High-Accuracy Benchmark Energies for Noncovalent Interactions,'' D. A. Sirianni, L. A. Burns, and C. D. Sherrill, J. Chem. Theory Comput. 13, 86-99 (2017) (doi: 10.1021/acs.jctc.6b00797)

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