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Vina_vision

AutoDock Vina improved: molecular movie, partial flexibility, atomic-level interaction diagrams.

About

Vina_vision is an improved version of AutoDock Vina under active development at BIO-HPC. It adds features that no other docking program currently offers in a single tool:

Beyond docking, it provides detailed, publication-ready output: atomic contributions to interaction energies, and 2D protein–ligand interaction diagrams (via PoseView integration).

The program is currently in beta and a public release is planned for Q4 2026.

Key features

Molecular movie output

Exports docking results as a frame-by-frame movie of the docking trajectory.

Partial ligand flexibility

Allows specified parts of the ligand to be kept fixed — useful in lead optimisation.

Tunable scoring

Scoring-function weights can be customised for specific protein–ligand atom pairs.

Atomic interaction diagrams

2D protein–ligand interaction diagrams via PoseView for figures and reports.

Demo video

Example output

Vina_vision docking pose example output

Access

Web server

Notify me when released

Beta — public release planned for Q4 2026

mailto:hperez@ucam.edu?subject=Vina_vision%20notify →

Citation

Methods paper in preparation. In the meantime, please cite the GitHub repository or contact us directly.

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