MTU Library Catalogue

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Foundations of molecular modeling and simulation : proceedings of the first international conference held in Keystone, Colorado, July 23-28, 2000 / edited by Peter T. Cummings and Phillip R. Westmorland.

By: (1st : International Conference on Foundations of Molecular Modeling and Simulation (1st : 2000 : Colorado).
Contributor(s): Cummings, Peter T | Westmorland, Phillip R. (Phillip Ray).
Material type: materialTypeLabelBookSeries: AIChE symposium series ; 325 v.97 2001.Publisher: New York : AIChE, 2001Description: x, 328 p. : ill. ; 29 cm. + hbk.ISBN: 0816908397.Subject(s): Molecular structure -- Computer simulation | Molecules -- Models -- Computer simulationDDC classification: 541.22
Contents:
Applications in industry -- Applying theory -- Modeling of polymers -- Biological applications -- Force fields and molecular simulations -- Kinetics and reaction engineering -- Visions of the present and future -- Chemical reactions and surface chemistry -- Molecular modeling methods -- Phase equilibria -- Transport processes -- Polymers and complex fluids -- Aqueous systems -- Biological systems -- Microporous materials.

Includes bibliographical references and indexes.

Applications in industry -- Applying theory -- Modeling of polymers -- Biological applications -- Force fields and molecular simulations -- Kinetics and reaction engineering -- Visions of the present and future -- Chemical reactions and surface chemistry -- Molecular modeling methods -- Phase equilibria -- Transport processes -- Polymers and complex fluids -- Aqueous systems -- Biological systems -- Microporous materials.