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autodock-vina

Here are 4 public repositories matching this topic...

bhaveshashok / AutoDockVina-BatchSubmission

A simple batch submission script to submit jobs to AutoDock Vina on Linux and MacOS developed by Bhavesh Ashok.

bioinformatics script computational-biology computational-chemistry biochemistry docking quantum-chemistry-programs bioinformatics-scripts autodock autodock-vina

Updated Jul 21, 2020
Shell

zhenglz / LBTS

Ligand based target searching

target-searching reverse-docking autodock-vina

Updated Oct 11, 2018
Shell

YiroTen / scripts4docking

Scripts for molecular docking

docking autodock-vina

Updated Nov 1, 2023
Shell

Amirreza-Mousavi / FjTAL_Virtual_Screening_QND

A quick and dirty virtual screening task for potential ligands of Flavobacterium johnsoniae Tyrosine Ammonia Lyase (FjTAL)

shell r ligand-screening virtual-screening molecular-docking autodock-vina ligand-receptor ligand-receptor-interaction

Updated Feb 20, 2022
Shell

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