SQM/COSMO Scoring Function at the DFTB3-D3H4 Level: Unique Identification of Native Protein-Ligand Poses. - Adam Pecina; Susanta Haldar; Jindrich Fanfrlík; René Meier 002; Jan Rezác; Martin Lepsík; Pavel Hobza (J. Chem. Inf. Model., 2017)

The Need for Continuing Blinded Pose- and Activity Prediction Benchmarks. - Christian Kramer; John D. Chodera; Kelly L. Damm-Ganamet; Michael K. Gilson; Judith Guenther; Uta F. Lessel; Richard A. Lewis; David L. Mobley; Eva Nittinger; Adam Pecina; Matthieu Schapira; W. Patrick Walters (J. Chem. Inf. Model., 2025)

Multiscale Computational Protocols for Accurate Residue Interactions at the Flexible Insulin-Receptor Interface. - Yevgen P. Yurenko; Anja Muzdalo; Michaela Cerneková; Adam Pecina; Jan Rezác; Jindrich Fanfrlík; Lenka Záková; Jirí Jirácek; Martin Lepsík (J. Chem. Inf. Model., 2025)