Evaluation of library ranking efficacy in virtual screening. - Maria Kontoyianni; Glenn S. Sokol; Laura M. McCellan (J. Comput. Chem., 2005)

Functional Prediction of Binding Pockets. - Maria Kontoyianni; Christopher B. Rosnick (J. Chem. Inf. Model., 2012)

A Structure-Based Approach to Understanding Somatostatin Receptor-4 Agonism (sst4). - Zhaomin Liu; A. Michael Crider; Daniel Ansbro; Christina Hayes; Maria Kontoyianni (J. Chem. Inf. Model., 2012)

Elucidating Substrate Promiscuity in the Human Cytochrome 3A4. - Christina Hayes; Daniel Ansbro; Maria Kontoyianni (J. Chem. Inf. Model., 2014)