Igor Ying Zhang

Publication Activity (10 Years)

Years Active: 2011-2019
Publications (10 Years): 1

Top Topics

Hybrid Approaches

Theoretical Basis

Highly Accurate

Top Venues

J. Comput. Chem.

Publications

Igor Ying Zhang, Jianming Wu, Xin Xu
Accurate heats of formation of polycyclic saturated hydrocarbons predicted by using the XYG3 type of doubly hybrid functionals. J. Comput. Chem. 40 (10) (2019)
Li Rao, Igor Ying Zhang, Wenping Guo, Li Feng, Eric Meggers, Xin Xu
Nonfitting protein-ligand interaction scoring function based on first-principles theoretical chemistry methods: Development and application on kinase inhibitors. J. Comput. Chem. 34 (19) (2013)
Neil Qiang Su, Igor Ying Zhang, Xin Xu
Erratum: analytic derivatives for the XYG3 type of doubly hybrid density functionals: Theory, implementation, and assessment. J. Comput. Chem. 34 (27) (2013)
Neil Qiang Su, Igor Ying Zhang, Xin Xu
Analytic derivatives for the XYG3 type of doubly hybrid density functionals: Theory, implementation, and assessment. J. Comput. Chem. 34 (20) (2013)
Wenping Guo, Anan Wu, Igor Ying Zhang, Xin Xu
XO: An extended ONIOM method for accurate and efficient modeling of large systems. J. Comput. Chem. 33 (27) (2012)
Igor Ying Zhang, Jianming Wu, Yi Luo, Xin Xu
Accurate bond dissociation enthalpies by using doubly hybrid XYG3 functional. J. Comput. Chem. 32 (9) (2011)