Inverse problem in QSAR/QSPR studies for the case of topological indexes characterizing molecular shape (Kier indices). - Mariya I. Skvortsova; Igor I. Baskin; Olga L. Slovokhotova; Vladimir A. Palyulin; Nikolai S. Zefirov (J. Chem. Inf. Comput. Sci., 1993)

Spectral Theory of Graphs in Chemistry. 1. Projection Operators and Canonical Numeration of Graph Vertices. - Ivan V. Stankevich; Elena G. Gal'pern; Anatolii L. Chistyakov; Igor I. Baskin; Mariya I. Skvortsova; Nikolai S. Zefirov; Oleg B. Tomilin (J. Chem. Inf. Comput. Sci., 1994)

On the Basis of Invariants of Labeled Molecular Graphs. - Igor I. Baskin; Mariya I. Skvortsova; Ivan V. Stankevich; Nikolai S. Zefirov (J. Chem. Inf. Comput. Sci., 1995)

Molecular Similarity. 1. Analytical Description of the Set of Graph Similarity Measures. - Mariya I. Skvortsova; Igor I. Baskin; Ivan V. Stankevich; Vladimir A. Palyulin; Nikolai S. Zefirov (J. Chem. Inf. Comput. Sci., 1998)