vina
There are 18 repositories under vina topic.
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
Valdes-Tresanco-MS/AMDock-win
(Windows) AMDock: Assisted molecular docking with AutoDock4 and AutoDockVina
aretasg/dockit
High-throughput molecular docking with multiple targets and ligands using Vina series engines
inpacdb/POAP
Parallelized Open Babel & Autodock suite Pipeline
ale94mleon/moldrug
moldrug (AKA mouse) is a python package for drug-oriented optimization on the chemical space
laeeq80/multi-vina
Dock Multiple Ligands with AutoDock Vina with one Command
chengwang88/vina4dv
A fork of Autodock Vina for DeltaVina scoring function
HongYhong/dock2interaction_profile
This is a simple script to use [plip](https://github.com/pharmai/plip) to batch analysis of interactions between proteins and ligands that are results of smina (vina) docking.
MiklosKralik/AlphaDock
Examines ligand interactions with predicted protein structures
nguyenanhung/vn-telco-phonenumber
Library detect carrier Vietnam telco: Viettel, Vina, MobiFone... & Format Phone number
gkxiao/unidock
some tips for using Uni-Dock
JayKayNJIT/covid19
Drug repurposing for SARS-COV-2: A high-throughput molecular docking, molecular dynamics, machine learning, & ab-initio study
gkxiao/gnina-scoring-function
Using GNINA scoring function to rank the pose
gkxiao/meeko_vina
Add molecule name into meeko pdbqt
gkxiao/openbabel_2433
Step to reproduce the OpenBabel PDBQT tree error resulting in re-docking failure.
insilichem/tangram_vinarelaunch
Easily relaunch failed AutoDock Vina OPAL jobs from UCSF Chimera
jRicciL/Taller_Simulacion_Molecular
Taller de docking molecular y dinámica molecular