Graphical User Interfaces (GUIs) like AutoDock Tools (ADT), PyRx, MGLTools, and older scripts are hardcoded to parse the exact command-line output format of version 1.1.2.
The legacy hosting site for original executables. 🛠️ Installation Steps by OS
Whether you are docking a or running a virtual library screening
For users requiring full verification, compiling from the official source code is the gold standard:
Move the file to a local directory (e.g., /usr/local/bin for system-wide access, or a local bin folder). autodock vina 112 download verified
Add this path to your Windows Environment Variables ( Path ) so you can run the vina.exe command from any folder using the Command Prompt ( cmd ). For Linux Users
Vina requires both receptors and ligands to be in .pdbqt format, which includes partial charges and atom types. You can use MGLTools (AutoDockTools) or Open Babel to perform this conversion.
sha256sum <filename>
AutoDock Vina is an open-source program for molecular docking, designed and implemented by Dr. Oleg Trott in the Molecular Graphics Lab at The Scripps Research Institute. It is one of the fastest and most widely used docking engines, known for significantly improving the average accuracy of binding mode predictions compared to earlier tools like AutoDock 4. Graphical User Interfaces (GUIs) like AutoDock Tools (ADT),
Are you planning to run Vina through a (like PyRx, Chimera, or AutoDockTools) or directly via the command line ?
sha256sum vina_1.1.2_linux_x86_64
Once AutoDock Vina 1.1.2 is securely installed, you will need to prepare your molecular files before initiating a simulation:
Navigate to your working directory via your command-line interface and run the following execution string: vina --config config.txt Use code with caution. Add this path to your Windows Environment Variables
He extracted the archive. The interface was spartan, a relic of a simpler time in bioinformatics. There were no bloated GUIs, no unnecessary background processes. Just raw, efficient C++ logic compiled for one purpose: predicting the future of chemical interactions.
It is crucial to note that v1.1.2 (last revision: May 2011) is the final version of the AutoDock Vina. While active development has since moved to newer engines like v1.2.x (2021–present) and AutoDock-GPU, version 1.1.2 remains a widely cited scientific benchmark and is still supported on many legacy systems and high-performance computing (HPC) clusters. The official legacy site, vina.scripps.edu , acknowledges that this version has been superseded but is kept open for informational purposes.
This is the primary official source.
Newer versions introduce changes to the scoring functions, force fields, and optimization parameters. Version 1.1.2 provides a stable baseline for historic data comparison.
Note: Legacy versions of Vina may require specific adjustments or older architecture compatibility settings on newer Apple Silicon (M1/M2/M3) macs via Rosetta 2. Download the Mac binary.