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modtox
Release 1.0.0.3

Asses toxic effect of drugs based on MD simualtions of HROT dataset

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Keywords: docking, ensemble-docking, machine-learning, modeling, molecular-dynamics, toxicity
License: MIT
Install: pip install modtox==1.0.0.3

Documentation

ModTox

Platform to check for toxicological effects based on apo and holo simulations of the HROT dataset

https://travis-ci.com/danielSoler93/ModTox.svg?branch=master

Installation

https://danielsoler93.github.io/ModTox/tutorial/index.html

Python API

https://danielsoler93.github.io/ModTox/tutorial/api_tutorial/index.html

Command line commands

https://danielsoler93.github.io/ModTox/tutorial/command_line_tutorial/index.html

Dependencies: 0
Dependent packages: 0
Dependent repositories: 0
Total releases: 4
Latest release: Sep 18, 2019
First release: Sep 18, 2019
Stars: 2
Forks: 1
Watchers: 0
Contributors: 2
Repository size: 40.5 MB
SourceRank: 7

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Releases

1.0.0.3: Sep 18, 2019
1.0.0.2: Sep 18, 2019
1.0.0.1: Sep 18, 2019
1.0.0: Sep 18, 2019

Contributors

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