chemical-space topic

CReM: chemically reasonable mutations framework

DrrDom

The backend services of the GenUI framework. The backend provides the REST API used for molecular generation, QSAR modelling and chemical space visualization.

martin-sicho

A python package for chemical space visualization.

mcsorkun

C++/Python Library for Systematic Chemical Space Exploration

lich-uct

Module containing scripts to perform multiple comparison simultaneously and getting the exact same value as the average pairwise comparisons of molecules represented by binary fingerprints or real num...

mqcomplab