ChemBFN: Bayesian Flow Network Framework for Chemistry Tasks. Developed in Hiroshima University.

MARS, Molecular Assembling and Representation Suite, is a program for general purpose computer aided molecular design. This program uses an integer arry data structure to store the information of atom type, atom connectivity, and bond order of a molecule. There are also subroutines that can be used to modify the data structure in order to genera…

A web-based UI to host ChemBFN generative models and visualise the generated molecules. 🛠️pip install chembfn-webui