Selected publications, all recent years:

Benltifa, M.; Hayes, J. M.; Vidal, S.; Gueyrard, D.; Goekjian, P. G.; Praly, J.; Kizilis, G.; Tiraidis, C.; Alexacou, K.; Chrysina, E. D.; Zographos, S. E.; Leonidas, D. D.; Archontis, G.; Oikonomakos, N. G., "Glucose-based spiro-isoxazolines: A new family of potent glycogen phosphorylase inhibitors", Bioorg. and Med. Chem., 2009, 17, 7368–7380.

Cho, A. E.; Rinaldo, D., "Extension of QM/MM docking and its applications to metalloproteins", J. Comput. Chem., 2009, 30, 2609–2616.

Chung, J. Y.; Hah, J.; Cho, A. E., "Correlation between Performance of QM/MM Docking and Simple Classification of Binding Sites", J. Chem. Inf. Model., 2009, 49, 2382–2387.

Cho, A. E.; Guallar, V.; Berne, B.; Friesner, R. A., "Importance of Accurate Charges in Molecular Docking: Quantum Mechanical/Molecular Mechanical (QM/MM) Approach", J. Comput. Chem., 2005, 26, 915-931