Taller de docking molecular y dinámica molecular
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Updated
Sep 6, 2023 - Jupyter Notebook
Taller de docking molecular y dinámica molecular
This repository contains the sample that explains how to create MVVM adapter for wpf docking manager for creating MVVM applications.
This example demonstrates how to completely hide the dock panel caption.
In silico identification of CDK1 inhibitors in colorectal cancer
Webpage of the HADDOCK group
The needed elements for three scenarios that use the MDRR.
Straightforwarding Scoring Suite (3S).
Smina is fork of AutoDock Vina that is customized to better support scoring function development and high-performance energy minimization. smina is maintained by David Koes at the University of Pittsburgh and is not directly affiliated with the AutoDock project. This fork of Smina adds changes that allow it to run as a part of DockingFactory.
Open-sourced. A cloud-based workflow to evaluate the confidence of a given docked pose with binding pose metadynamics
Vina MPI is a MPI ready version of the docking software Autodock Vina.
Autohotkey script that detects how many displays you have and then sets the wallpaper you define depending on how many displays. Useful when you Dock and Undock from a multi-monitor setup.
Adds Inflatable PicoPorts for Kerbal Space Program. Requires PicoPorts part mod and Making History (DLC).
mirror of https://gitlab.com/CaflischLab/SEED
Data for performing HADDOCK2.4 protocols
Scipion framework plugin for the use of tools provided by Schrodinger software suite
Finding redundancies and similarities in SMILES datasets
In silico simulation between metfomin and oestrogen receptors (ERalpha and ERbeta) and androgen receptors (AR)
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