Comparative Evaluation of MMPBSA and XSCORE To Compute Binding Free Energy in XIAP-Peptide Complexes. - Cristian Obiol-Pardo; Jaime Rubio-Martinez (J. Chem. Inf. Model., 2007)

A Multiscale Simulation System for the Prediction of Drug-Induced Cardiotoxicity. - Cristian Obiol-Pardo; Julio Gomis-Tena; Ferran Sanz; Javier Saiz; Manuel Pastor (J. Chem. Inf. Model., 2011)