Computational Medicinal Chemistry for Drug Discovery
Patrick Bultinck, Jan P. Tollenaere, Wilfried Langenaeker, Hans De Winter
Presents semi-empirical, hybrid, and quantum chemical methods and explores reactivity, molecular, and quantum-chemical descriptors in QSAR. Views pharmacophore discovery and the use of 3D pharmacophore models in 3D database searching. Studies vibrational circular dichroism spectroscopy for the sterochemical characterization of chiral molecules.
种类:
年:
2004
出版:
1
出版社:
Marcel Dekker
语言:
english
页:
781
ISBN 10:
0824747747
ISBN 13:
9780824747749
文件:
PDF, 19.78 MB
IPFS:
,
english, 2004