Alan Hinchliffe
Molecular modelling for beginners
Gedrukt boek
"Molecular Modelling for Beginners is a self contained introduction to modelling and computational chemistry. - Assuming only a basic knowledge of physical chemistry, physics and mathematics, relevant introductory material is provided to ensure greater accessibility to this exciting subject. Carefully structured, the text begins by presenting the fundamental theories that are based on classical mechanics, classical electrostatics and statistical thermodynamics. - The focus is on Molecular Mechanics, Monte Carlo and Molecular Dynamics. - Emphasis is given to discovery chemistry and QSAR, and the text successfully combines essential theory with relevant applications and examples designed to encourage student understanding. - "This text will appeal to those students taking undergraduate courses in chemistry, biochemistry and materials science who want to explore the latest techniques of molecular modelling."--BOOK JACKET
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