3 Repositories
Latest Python Libraries
DockStream: A Docking Wrapper to Enhance De Novo Molecular Design
DockStream Description DockStream is a docking wrapper providing access to a collection of ligand embedders and docking backends. Docking execution an
72 Jan 02, 2023
A pythonic interface to high-throughput virtual screening software
pyscreener A pythonic interface to high-throughput virtual screening software Overview This repository contains the source of pyscreener, both a libra
56 Dec 15, 2022
Jupyter Dock is a set of Jupyter Notebooks for performing molecular docking protocols interactively, as well as visualizing, converting file formats and analyzing the results.
Molecular Docking integrated in Jupyter Notebooks Description | Citation | Installation | Examples | Limitations | License Table of content Descriptio
173 Dec 25, 2022