Journal of medicinal chemistry
Acylpyruvates as potential antifungal agents
H Burch, JE Gray
Index: Burch,H.A.; Gray,J.E. Journal of Medicinal Chemistry, 1972 , vol. 15, p. 429 - 431
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Citation Number: 25
Abstract
Methods All calcns were in the Extended Huckel approximation as described by Hoffmann.'The input required was detd from a program supplied by the University of Indiana's Quantum Chemistry Program Exchange. This program calcs precise 3- dimensional atomic coordinates necessary for Extended Huckel Theory (EHT). All bond angles and bond lengths were of standard magnitude as described by SuttonS8 The EHT ...