autodocktools

There are 4 repositories under autodocktools topic.

  • Metaphorme/AutoDock-Vina-Docker

    Package AutoDock Vina, ADFR suite, Meeko, MGLTools into Docker Image.

    10122

  • luqmanzaceria/ligand-docking-script

    Computational Drug Screening Platform

    Language:Python1100

  • jonathanfernandi/Capsaicin

    This repository contains Jonathan et al.'s AoL (Assurance of Learning) Project for SCIE6062001 - Computational Biology Course.

    0100

  • RackS103/Batch-HTVS

    A Bash script to submit batch jobs to ORCA, OpenBabel, MGLTools, and Autodock Vina. Automatically checks for syntax errors in ORCA input files, and can also identify ORCA runtime crashes. Organizes log files into individual directories, and creates an easy to read results summary text file. Created by Rac Mukkamala

    Language:Python0100