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A fast algorithm for calculation of the distance matrix of a molecule
Author(s) -
Bersohn Malcom
Publication year - 1983
Publication title -
journal of computational chemistry
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 0.907
H-Index - 188
eISSN - 1096-987X
pISSN - 0192-8651
DOI - 10.1002/jcc.540040115
Subject(s) - algorithm , matrix (chemical analysis) , computer science , mathematics , chemistry , chromatography
A rapid method is described for calculating the number of bonds on the shortest path between each two pairs of atoms of a molecule.