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Computer Generation of Molecular Structures by the SMOG Program

✍ Scribed by Molchanova, M.S.; Shcherbukhin, V.V.; Zefirov, N.S.

Book ID
125506154
Publisher
American Chemical Society
Year
1996
Tongue
English
Weight
368 KB
Volume
36
Category
Article
ISSN
0095-2338

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## Abstract **Summary:** A computer program has been developed to generate three‐dimensional molecular structures randomly from a given collection of elementary chemical functional groups: the so‐called fragment database. The gradual assembly of the various fragments present in the database is perf