Computational Medicinal Chemistry for Drug Discovery

Contributor(s):

Material type: Text

TextPublication details: New York Marcel Dekker, Inc. 2004Description: 794pISBN:

9780824747749

Subject(s):

Medicinal Chemistry

DDC classification:

615.19 COM

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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	615.19 COM (Browse shelf(Opens below))	Available		P0006919
Reference Book	NIMA Knowledge Centre	6th Floor Silence Zone	Reference	615.19 COM (Browse shelf(Opens below))	Not For Loan		P0002008

Total holds: 0

Observing computational chemistry's proven value to the introduction of new medicines, this reference offers the techniques most frequently utilized by industry and academia for ligand design. Featuring contributions from more than fifty pre-eminent scientists, Computational Medicinal Chemistry for Drug Discovery surveys molecular structure computation, intermolecular behavior, ligand-receptor interaction, and modeling responding to market demands in its selection and authoritative treatment of topics. The book examines molecular mechanics, semi-empirical methods, wave function-based quantum chemistry, density functional theory, 3-D structure generation, and hybrid methods.

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