Qspr Python Packages

bayesianflow-for-chem

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

fastprop

Fast Molecular Property Prediction with mordredcommunity

ecnet

QSPR-based PyTorch models for fuel property prediction, with bundled datasets and analytical blend rules

spectrafp

A package to perform fingerprints from spectroscopy datas.

qsprpred

A tool for creating Quantitative Structure Property/Activity Relationship (QSPR/QSAR) models.

molbokeh

A new python package to visualize molecules in dots hover

qsarmodelingpy-gui

A white-box tool for building QSAR models. Free and open-source.