Goodman, Jonathan M.

Chemical applications of molecular modelling / Jonathan M. Goodman. - Cambridge : Royal Society of Chemistry, c1998. - xv, 216p., [8]p. of plates : ill. (some col.) ; 24 cm.

Includes bibliographical references (p. 203-211) and index.

1.Introduction -- 2.Force fields -- 3.Minimisation -- 4.Conformation searching -- 5.Molecular dynamics -- 6.Molecular orbital theory -- 7.Databases -- 8.Applications. 1.Introduction -- 2.Force fields -- 3.Minimisation --

As computers become an important part of everyday life, molecular modelling is affecting all parts of chemistry, and is particularly useful in organic chemistry. But how does it work? This book examines the chemical uses for molecular modelling.

9780854045792 (pbk.) : �25.00 0854045791 (pbk) �35.01


Chemistry--Computer simulation
Molecular structure--Data processing
Molecules--Models--Computer simulation
Science.
Quantum & theoretical chemistry
Computer science

QD480 / .G66 1998

615.1900285 GOO

QD480.G66 / 1998