TY  - BOOK
AU  - Bachrach,Steven M.
TI  - Computational organic chemistry
SN  - 9781118671221
AV  - QD255.5.M35 
U1  - 547.001/51 23
PY  - 2014///
CY  - Hoboken, New Jersey
PB  - Wiley
KW  - Chemistry, Organic
KW  - Mathematics
KW  - Mathematical models
KW  - SCIENCE
KW  - Chemistry
KW  - Organic
KW  - bisacsh
KW  - fast
KW  - Electronic books
N1  - Includes bibliographical references and index; ps
N2  - Building upon and updating the successful first edition, the second edition of Computational Organic Chemistry introduces computational modeling methods used as standard tools by organic chemists for searching, rationalizing, and predicting structure and reactivity of organic molecules. New coverage includes: significant problems with standard DFT (density functional theory) methods; ways to address these problems; computational organic spectroscopy; computational tools for understanding enzyme mechanisms; and new interviews. The text is particularly valuable to organic, physical organic, synt
UR  - http://dx.doi.org/10.1002/9781118671191
ER  -