Docking
Beginner’s Guide for Docking using Autodock Vina
We have compiled all articles on docking into a Special Issue. This is a complete guide on molecular docking using Autodock Vina for beginners. It includes blind docking, site-specific docking, installation, output analysis, and so on.
This issue includes the following articles:
- How to install AutoDock Vina on Ubuntu?
- Video tutorial: How to install Autodock Vina on Ubuntu?
- How to perform docking in a specific binding site using AutoDock Vina?
- Video Tutorial: How to perform docking using Autodock Vina
- How to perform blind docking using AutoDock Vina?
- Tutorial: Vina Output Analysis Using PyMol
- Video Tutorial: Autodock Vina Result Analysis with PyMol
- Vina output analysis using Discovery Studio visualizer
- Autodock VinaXB for molecular docking of protein complexes containing halogen bonding interactions
- How to install Raccoon plugin on Ubuntu for virtual screening using Autodock?
- Raccoon2: A GUI facilitating virtual screenings with Autodock and Autodock Vina
- How to perform virtual screening using Autodock Vina?
- Site-specific docking: Frequently Asked Questions & answers for starters
- MGL Tools & Autodock Vina installation: Frequently Asked Questions and Answers
You can also find this special issue on Bioinformatics Review E-Prints.
After performing computational docking, a question that comes to mind most is “what docking score is considered good or bad”. In this article, we will discuss this in detail. (more…)
Bioinformatics Programming
How to sort binding affinities based on a cutoff using vs_analysis.py script?
Previously, we have provided a Python script (vs_analysis.py) to analyze the virtual screening (VS) results of Autodock Vina. Now, we have updated this script to sort binding affinities based on user inputted cutoff value. (more…)
Virtual Screening (VS) is one of the important techniques in bioinformatics. It can be easily performed using Autodock Vina. We have provided detailed articles on this topic. In this article, we are trying to answer some FAQs for beginners. (more…)
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