Bond-based 2D TOMOCOMD-CARDD approach for drug discovery: aiding decision-making in 'in silico' selection of new lead tyrosinase inhibitors. - Yovani Marrero-Ponce; Mahmud Tareq Hassan Khan; Gerardo M. Casañola-Martín; Arjumand Ather; Mukhlis N. Sultankhodzhaev; Ramón García-Domenech; Francisco Torrens; Richard Rotondo (J. Comput. Aided Mol. Des., 2007)

Determinants for Psychrophilic and Thermophilic Features of Metallopeptidases of the M4 Family. - Mahmud Tareq Hassan Khan; Ingebrigt Sylte (Silico Biol., 2009)

Specific interactions and binding free energies between thermolysin and dipeptides: Molecular simulations combined with Ab initio molecular orbital and classical vibrational analysis. - Kenichi Dedachi; Tatsuya Hirakawa; Seiya Fujita; Mahmud Tareq Hassan Khan; Ingebrigt Sylte; Noriyuki Kurita (J. Comput. Chem., 2011)

Retrained Classification of Tyrosinase Inhibitors and "In Silico" Potency Estimation by Using Atom-Type Linear Indices: A Powerful Tool for Speed up the Discovery of Leads. - Gerardo M. Casañola-Martín; Mahmud Tareq Hassan Khan; Huong Le-Thi-Thu; Yovani Marrero-Ponce; Ramón García-Domenech; Francisco Torrens; Antonio Rescigno (Int. J. Chemoinformatics Chem. Eng., 2012)