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Journal of Chemical Information and Modeling· 2021Q1

AutoDock Vina 1.2.0: New Docking Methods, Expanded Force Field, and Python Bindings

Jérôme Eberhardt, Diogo Santos‐Martins, Andreas F. Tillack, Stefano Forli

Short summary

AutoDock Vina 1.2.0 now supports macrocycle and explicit water molecule modeling, previously a limitation compared to other AutoDock programs.

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Field: Computational Theory and Mathematics

Computational Theory and MathematicsComputer Science