Electronic structure calculations on the thiazole-containing antibiotic thiostrepton: molecular mechanics, semi-empirical and ab initio analyses |
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Authors: | Hang Pei C Honek John F |
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Affiliation: | Department of Chemistry, University of Waterloo, Waterloo, Ontario, N2L 3G1, Canada. |
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Abstract: | Thiostrepton is a highly complex cyclic thiazoyl peptide antibiotic and is active against Gram-positive bacteria. Molecular mechanics, semi-empirical and ab initio studies were utilized to further understand the structural and electronic properties of this antibiotic. |
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