Computer system for structure recognition of polyatomic molecules by i.r., n.m.r., u.v. and m.s. methods
1977; Elsevier BV; Volume: 95; Issue: 2 Linguagem: Inglês
10.1016/s0003-2670(00)84984-3
ISSN1873-4324
AutoresЛ. А. Грибов, Mikhail Elyashberg, V.V. Serov,
Tópico(s)Various Chemistry Research Topics
ResumoA system of algorithms and programs for the recognition of the structures of polyatomic molecules by means of i.r., n.m.r., u.v. and mass spectra is described. Examples of structures identified are cited. The results are promising and suggest that the system could be used for the identification of complex organic compounds.
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