Software for performing Automatic Ligand-guided Backbone Ensemble Receptor Optimization with ICM
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Updated
Apr 28, 2016 - Perl
Software for performing Automatic Ligand-guided Backbone Ensemble Receptor Optimization with ICM
Your one-stop solution for protein-ligand docking. This pipeline simplifies molecular docking, helping researchers study protein-ligand interactions efficiently. It offers clear instructions and customizable options for easy virtual screening. Simplify drug discovery, explore confidently!
The necessary files to automatically set up dual monitors when docking my Thinkpad T430.
Bachelor thesis
Docking Factory is a tool to automate molecular docking runs on an HPC cluster using the Dask framework. DockingFactory provides unified way of running molecular docking with different software backends: AutoDock Vina, Smina, Qvina2, and rDock.
This example demonstrates how to completely hide the dock panel caption.
UV-sterilization-bot
Automatic identification of important interactions and interaction-frequency-based scoring in protein-ligand complexes
In silico identification of CDK1 inhibitors in colorectal cancer
“DroidNet” is a robust suite of sub-projects for WinUI app development, focusing on automation and quality assurance. Its modular architecture makes it a powerful tool for developers working with WinUI and Windows App SDK.
Webpage of the HADDOCK group
Terminal with docking as Visual Code and integrating with helpfull features...
This is a work to improve molecular docking speed. Normally docking a ligand on a target protein is done with some very complex functions and it is often slow. This work uses Neural Networks to model ligands on target proteins to measure whether they are active or not.
Vina MPI is a MPI ready version of the docking software Autodock Vina.
Provides standalone DockPanel libraries for Silverlight web-based and Windows Phone projects, based on Silverlight Toolkit sourcecode
The needed elements for three scenarios that use the MDRR.
Add a description, image, and links to the docking topic page so that developers can more easily learn about it.
To associate your repository with the docking topic, visit your repo's landing page and select "manage topics."