PUBLICATIONS IN SCIENTIFIC JOURNALS






Discovery of New Classes of Glycine transporter 2 (GlyT2) Inhibitors and GlyT2 Selectivity Studies by Combination of Novel Structural Based Virtual Screening Approach and Free Energy Perturbation (FEP+) Calculations

Filip Fratev

An Improvement of the Free Energy Perturbation (FEP+) Sampling Protocol in Case of Flexible protein Ligand Binding Sites

Filip Fratev

Prediction of Accurate Binding Modes using Combination of classical and accelerated Molecular dynamics and Free Energy Perturbation Calculations: An Application to Toxicity Studies

Filip Fratev






Combination of Structural based Pharmacophore and Docking Virtual Screens: An Efficient Structure-based Protocol for Lead Identification

Filip Fratev
















An in silico study of the molecular basis of B-RAF activation and conformational stability

Filip F Fratev* and Svava Ósk Jónsdóttir

BMC Structural Biology