The program is reorganized as a Python module and minor fixes were made in README.
1.1.0
Changed the canonical enumeration algorithm that affected the descriptor names which became incompatible with the previous release 1.0.1.
1.0.1
Descriptors for single compounds, quasi-mixtures, mixtures and reactions. Variable size of considered fragments. Human readable SMILES-like descriptor notation.
0.1
Calculation of simplex and property-labelled simplex descriptors for single compounds and mixtures of arbitrary composition.