Molecular Modeling and Prediction of Bioactivity

Contributor(s):

Material type: Text

TextPublication details: New York Plenum Press 2000Description: 502pISBN:

9780306462177

Subject(s):

DDC classification:

615.19 MOL

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Holdings
Item type	Current library	Item location	Collection	Call number	Status	Date due	Barcode	Item holds
Reference Book	NIMA Knowledge Centre	6th Floor Silence Zone	Reference	615.19 MOL (Browse shelf(Opens below))	Not For Loan		P0007720

Total holds: 0

The book covers highly important topics in the challenging process from lead finding to drug candidates. Focus is upon the potential usefulness of methods for design of lead discovery libraries, lead optimisation, computational chemistry methods for the calculation of energetics of protein-ligand interaction, and computer simulations of biological activities. Important topics include new developments in chemometrics and rational molecular design as well as different aspects of structure representation, knowledge-based approaches to structure identification, and information handling.

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