Pose Prediction Accuracy in Docking Studies and Enrichment of Actives in the Active Site of GSK-3β. - Pravin Kumar Gadakar; Samiron Phukan; Prasanna Dattatreya; V. N. Balaji (J. Chem. Inf. Model., 2007)

Mechanistic insights into PROTAC-mediated degradation through an integrated framework of molecular dynamics, free energy landscapes, and quantum mechanics: A case study on kinase degraders. - Ashis Nandy; Kiran Boppana; Samiron Phukan (J. Comput. Aided Mol. Des., 2025)