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AutoDock, AutoLigand, MGLTools, Vina, PyRx and more.
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PostPosted: Fri Feb 05, 2016 7:36 pm 
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Joined: Sun Jan 31, 2016 4:36 pm
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I've performed docking with autodock vina, I can see the receptor ligand interaction using GUI of autodock tools but as I have quite a number of vina results, its getting tiresome every time doing same clickery over and over.

Is it possible to find a script doing the task all at once? I mean taking macromolecule and vina output and generate interacting ligands?


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