jstar-lbvs.js

jstar‘s daemon for ligand-based virtual screening (LBVS), written in JavaScript.

A C++ implementation is available at https://github.com/HongjianLi/jstar-lbvs.cpp

Usage

node main.js --databases ../jstar/databases --host localhost --port 27017 --user jstard --pass password

Architecture

Components

Database

• MongoDB

Daemon

• MongoDB Node.js Driver
• rdkit
• piscina
• commander

License

MIT License

Developers

• Jacky Lee
• Jessie Sze

Logo

GitHub

View Github