autodock
There are 23 repositories under autodock topic.
AngelRuizMoreno/Jupyter_Dock
Jupyter Dock is a set of Jupyter Notebooks for performing molecular docking protocols interactively, as well as visualizing, converting file formats and analyzing the results.
MengwuXiao/GetBox-PyMOL-Plugin
A PyMOL Plugin for calculating docking box for LeDock, AutoDock and AutoDock Vina.
Valdes-Tresanco-MS/AMDock
(Linux and macOS) AMDock: Assisted molecular docking with AutoDock4 and AutoDockVina
SynapseProgramming/lidar_auto_docking
package for docking ros2 robots. (based off fetch open auto dock)
aretasg/dockit
High-throughput molecular docking with multiple targets and ligands using Vina series engines
inpacdb/POAP
Parallelized Open Babel & Autodock suite Pipeline
laeeq80/multi-vina
Dock Multiple Ligands with AutoDock Vina with one Command
Metaphorme/AutoDock-Vina-Docker
Package AutoDock Vina, ADFR suite, Meeko, MGLTools into Docker Image.
MiklosKralik/AlphaDock
Examines ligand interactions with predicted protein structures
laeeq80/multi-qvina
Accurately speed up AutoDock Vina and multiple ligands at a time.
Orpowell/autodock-vina-automator
A script to run docking experiments in AutoDock Vina for several ligands at once with technical replicates.
r4dbot/Biomolecular-simulation
Compilations of hands-on project Biomolecular simulations
AlpMercan/Turtlebot3-Aruco-Autodocking
A simple turtlebot 3 Aruco Autodocking Algorithm
bhaveshashok/AutoDockVina-BatchSubmission
A simple batch submission script to submit jobs to AutoDock Vina on Linux and MacOS developed by Bhavesh Ashok.
pritampanda15/Structify-Chemical-Structure-Converter
Structify is a lightweight and efficient tool for converting chemical structure file formats. Structify simplifies the process of converting between formats commonly used in computational chemistry and molecular docking workflows.
esa-tu-darmstadt/AutoDock-Aurora
AutoDock molecular docking for the NEC SX-Aurora TSUBASA
scipion-chem/scipion-chem-autodock
Scipion framework plugin for the use of tools provided by Autodock software suite
NikitaArya17/molecular_docking
This repository provides a demonstration of basic molecular docking using software tools such as AutoDock and ChimeraX. These techniques form part of the curriculum of the Bioinformatics practical course offered by Ahmedabad University, under the course code BIO205.
ruslankhabirov/Biocad-a-specialist-in-structural-bioinformatics-test-task
Test task for the position of a specialist in structural bioinformatics in the BIOCAD Corporation
taka78/ultidock
An Autodock Vina automation project with basic data analysis tools.
insilichem/tangram_vinarelaunch
Easily relaunch failed AutoDock Vina OPAL jobs from UCSF Chimera
jRicciL/Taller_Simulacion_Molecular
Taller de docking molecular y dinámica molecular
Sarah-Hesham-2022/Drug-Design-AutoDock-Tools-MBP-D-Ribose
Molecular docking is one of the molecular modeling methods that predicts the preferred orientation of one molecule (ligand) to another (receptor) when bound to each other to form a stable complex (lowest energy state).