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- W2951403721 abstract "The problem of exhaustive and irredundant generation was solved for the case of organic structural isomers sharing the same molecular formula and containing some predefined fragmentsa set of arbitrary “core” fragments that are known in advance and may be used as ready construction units for generation along with separate atoms. The algorithm was implemented in the SMOG software, which had been described in an earlier publication in this Journal.1 Some examples are presented to illustrate the correctness and performance of the algorithm." @default.
- W2951403721 created "2019-06-27" @default.
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- W2951403721 date "2010-06-23" @default.
- W2951403721 modified "2023-09-26" @default.
- W2951403721 title "ChemInform Abstract: Irredundant Generation of Isomeric Molecular Structures with Some Known Fragments." @default.
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- W2951403721 doi "https://doi.org/10.1002/chin.199816272" @default.
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