Grant Schmadeke

发表

AutoDock VinaXB: implementation of XBSF, new empirical halogen bond scoring function, into AutoDock Vina

Suman Sirimulla, Richard G. Posner, Mathew R. Koebel, 2016, Journal of Cheminformatics.

S···O and S···N Sulfur Bonding Interactions in Protein-Ligand Complexes: Empirical Considerations and Scoring Function

Suman Sirimulla, Soyoung Jeon, Aaron Cooper, 2016, J. Chem. Inf. Model..