Molecular Modeling: Principles and Applications

By:

Leach, Andrew R

Material type: Text

TextPublication details: New York Prentice Hall 2001Edition: 2nd edDescription: 744pISBN:

9780582382107

Subject(s):

Molecular Modeling

DDC classification:

541.220113 LEA

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Holdings
Item type	Current library	Item location	Collection	Call number	Status	Date due	Barcode	Item holds
Book	NIMA Knowledge Centre	9th Floor Reading Zone	General	541.220113 LEA (Browse shelf(Opens below))	Available		P00670

Total holds: 0

Useful Concepts in Molecular Modelling An Introuction to Computational Quantum Mechanics Advanced ab initio Methods, Density Functional Therory & Solid-State Quantum Mechanics Empirical Force Field Models: Molecular Mechanics Energy Minimisation & Related Methods for Exploring the Energy Surface Computer Simulation Methods Molecular Dynamics Simulation Methods Monte Carlo Simulation Methods Conformational Analysis Protein Structure Prediction, Sequence Analysis & Protein Floding Four Challenges in Molecular Modelling: Free Energiews, Solvation, Reactions & Solid-state Defects The Use of Molecular Modelling & Chemoinformatics to Discover & Design new Molecular

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