+39 328 8436795

BiKi MD-Binding

MD-Binding: A complete solution for  fast binding protein-ligand based on molecular dynamics
Contact us


Full flexibility represents a major issue in protein-ligand binding and structure-based virtual screening. MD-Binding is a new module of BiKi Life Sciences based on enhanced sampling molecular dynamics. BiKi MD-Binding allows for dynamical binding with full flexibility of backbone and side chains.

The MD-Binding  has been awarded in the poster competition at the  Tenth edition of European Workshop in Drug Design 2015  in Siena (Italy).

A. Spitaleri et al, Fast Dynamic Docking Guided by Adaptive Electrostatic Bias: The MD-Binding Approach. J. Chem. Theory Comput