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Journal of Chemical Theory and Computation|December 8, 2015
Using Hessian Updating To Increase the Efficiency of a Hessian Based Predictor-Corrector Reaction Path Following MethodH P Hratchian, H B SchlegelChemico-Biological Interactions|September 1, 1981
The relationship of the carcinogenic/mutagenic potential of arylamines to their singlet-triplet nitrenium ion energiesG D Hartman, H B SchlegelJournal of the American Chemical Society|June 14, 2001
Inversion versus retention of configuration for nucleophilic substitution at vinylic carbonR D Bach, A G Baboul, H B SchlegelJournal of the American Chemical Society|March 29, 2001
A single transition state serves two mechanisms: an ab initio classical trajectory study of the electron transfer and substitution mechanisms in reactions of ketyl radical anions with alkyl halidesV Bakken, D Danovich, S Shaik, et al.Biochemistry|September 26, 2001
Mechanism of ascorbic acid oxidation by cytochrome b(561)D Njus, M Wigle, P M Kelley, et al.Bioorganic & Medicinal Chemistry|March 18, 2000
para-Substituted N-nitroso-N-oxybenzenamine ammonium salts: a new class of redox-sensitive nitric oxide releasing compoundsA D McGill, W Zhang, J Wittbrodt, et al.Journal of the American Chemical Society|July 18, 2001
Insight into the complex and dynamic process of activation of matrix metalloproteinasesL P Kotra, J B Cross, Y Shimura, et al.Inorganic Chemistry|November 27, 2001
Early transition metal complexes containing 1,2,4-triazolato and tetrazolato ligands: synthesis, structure, and molecular orbital studiesC Yélamos, K R Gust, A G Baboul, et al.The Journal of Organic Chemistry|September 1, 2001
Fluorophore-labeled S-nitrosothiolsX Chen, Z Wen, M Xian, et al.Journal of Medicinal Chemistry|August 1, 1984
Structure-activity, theoretical, and X-ray studies on the intramolecular interactions in a series of novel histamine H2 receptor antagonistsW C Lumma, J J Baldwin, J B Bicking, et al.Pageof 1