Concepedia
Journal of Natural Medicines · 2012 · 21 citations · 31 references
Life SciencesBotanyPlant SciencesPlant SystematicsFlavonoid Biosynthesis
31
Development of the Colle-Salvetti correlation-energy formula into a functional of the electron density
Chengteh Lee, Weitao Yang, Robert G. Parr · Physical review. B, Condensed matter · 1988 · 100.1K citations
Natural Sciences, Chemistry, Physics +17
Density-functional exchange-energy approximation with correct asymptotic behavior
Axel D. Becke · Physical review. A, General physics · 1988 · 53.5K citations
Fully optimized contracted Gaussian basis sets for atoms Li to Kr
Ansgar Schäfer, Hans W. Horn, Reinhart Ahlrichs · The Journal of Chemical Physics · 1992 · 9.6K citations
Natural Sciences, Chemistry, Physics +11
Merck molecular force field. I. Basis, form, scope, parameterization, and performance of MMFF94
Thomas A. Halgren · Journal of Computational Chemistry · 1996 · 5.3K citations
Natural Sciences, Biophysics, Computational Chemistry +12
Macromodel—an integrated software system for modeling organic and bioorganic molecules using molecular mechanics
F. MOHAMADI, Nigel G. J. Richards, Wayne C. Guida et al. · Journal of Computational Chemistry · 1990 · 3.8K citations
Natural Sciences, Chemistry, Biomolecular Modeling +13