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Documents Semi-Empirical Methods: Where is the Rest? Matthew Grandbois CHEM 381 Spring 2004.

Slide 1Semi-Empirical Methods: Where is the Rest? Matthew Grandbois CHEM 381 Spring 2004 Slide 2 Introduction Computational chemistry is one of the fastest growing areas…

Documents Next-generation DFT-based quantum models for simulations of biocatalysis Darrin M. York University.....

Next-generation DFT-based quantum models for simulations of biocatalysis Darrin M. York University of Minnesota Minneapolis, Minnesota USA http://theory.chem.umn.edu Outline…

Documents Thermodynamic Versus Kinetic Reaction Control

Kinetic vs. Thermodynamic Control in Organic Reactions John Cullen August, 1997 The concept of kinetic vs. thermodynamic control of reactions is an important one in organic…