Mathematical Descriptors of Molecules and Biomolecules

Approaching modeling in chemoinformatics and bioinformatics using mathematical descriptors: Some comments on the emerging landscape and future directions.- Hierarchy of descriptors: from topology to bio-descriptors.- Chirality Descriptors for Numerical Characterization of Enantiomers and Diastereomers.- QSAR Modeling Using Molecular Fragment Descriptors.- Quantitative Structure-Activity Analysi...