Rao, L.; Zhang, I. Y.; Guo, W.; Feng, L.; Meggers, E.; Xu, X. *, Nonfitting protein–ligand interaction scoring function based on first-principles theoretical chemistry methods: Development and appl

Rao, L.; Zhang,  I. Y.; Guo, W.; Feng, L.; Meggers, E.; Xu, X. *, Nonfitting protein–ligand  interaction scoring function based on first-principles theoretical chemistry  methods: Development and application on kinase inhibitors. J. Comput. Chem. 2013, 34 (19),  1636-1646.