Melting Point Profile of Organic Molecules and the 3D molecular assemblage of a case-study molecule in the mp region (Reproducibility Information)

These datasets comprise a comprehensive stepwise build-up of a melting point model set on the combined use of MOLMAP codification approach of organic molecules and the Random Forest algorithm. The resultant model combined with the gettree.class and simtv.class programs are used to obtain the 3D spatial arrangement in the melting point region of 2-(2,4-dichlorophenoxy)acetic acid (2,4-D). Check Method.pdf for complete information.