Open access
Jul 2026
P2MAT: A machine learning (ML) driven software for Property Prediction of MATerial.
This study presents a data-driven machine learning approach to predict the melting points of organic compounds, leveraging both 2D and 3D molecular descriptors and indicates that ML models can significantly improve melting-point predictions, providing a robust tool for the scientific community.
Md Kamruzzaman, Alexander Landera, N. Menon et al.
· Journal of Cheminformatics · 1 citation