Molecular Descriptors for Chemoinformatics, 2 Volume Set

Volume I: Alphabetical Listing / Volume II: Appendices, References

AvRoberto Todeschini,Viviana Consonni

Inbunden, Engelska, 2009

Del 41 i serien Methods & Principles in Medicinal Chemistry

4 283 kr

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Beskrivning

Molecular Descriptors for Chemoinformatics As every chemist knows, there is a direct (if complex) relationship between the molecular structure of a compound and its chemical behavior. Predicting such behavior is possible by an abstract representation of its structure in terms of chemical similarity parameters, socalled ‘descriptors’. These are most useful in predicting the pharmacological properties of drug candidates, but are also used in predicting reactivity, toxicity and other important chemical characteristics. The number-one reference on the topic now contains a wealth of new data: The entire relevant literature over the past eight years has been pain-stakingly surveyed, resulting in hundreds of new descriptors being added to the list, and some 3,000 new references in the bibliography section. Volume 1 contains an alphabetical listing of around 3300 terms for the chemoinformatic analysis of chemical compound properties, while the second volume contains 6343 references selected from 450 journals with about 7000 authors quoted covering the period from the beginning of molecular descriptor research until the year 2008. In this second edition, several sections have been completely rewritten and organized in a more effective way. The greatly expanded introductory section now contains several “walk-through” reading lists of selected keywords to make the data even more accessible for novice users.

Produktinformation

Utgivningsdatum:2009-07-15
Mått:185 x 244 x 74 mm
Vikt:2 731 g
Format:Inbunden
Språk:Engelska
Serie:Methods & Principles in Medicinal Chemistry
Antal sidor:1 257
Upplaga:2
Förlag:Wiley-VCH Verlag GmbH
ISBN:9783527318520

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Mer om författaren

Roberto Todeschini is full professor of chemometrics at the Department of Environmental Sciences of the University of Milano-Bicocca (Milano, Italy), where he constituted the Milano Chemometrics and QSAR Research Group. His main research activities concern chemometrics in all its aspects, QSAR, molecular descriptors, multicriteria decision making and software development. President of the International Academy of Mathematical Chemistry, president of the Italian Chemometric Society and “ad honorem” professor of the University of Azuay (Cuenca, Ecuador), he is author of more than 170 publications in international journals and of the books “The Data Analysis Handbook”, by I.E. Frank and R. Todeschini, 1994; and “Handbook of Molecular Descriptors”, by R. Todeschini and V. Consonni, 2000.Viviana Consonni received her PhD in chemical sciences at the University of Milano in 2000 and is now full researcher of chemometrics and chemoinformatics at the Department of Environmental Sciences of the University of Milano-Bicocca (Milano, Italy). She is a member of the Milano Chemometrics and QSAR Research Group and has 10 years experience in multivariate analysis, QSAR, molecular descriptors, multicriteria decision making and software development. She is author of more than 40 publications in peer reviewed journals and of the book “Handbook of Molecular Descriptors”, by R. Todeschini and V. Consonni; 2000. In 2006 she obtained the International Academy of Mathematical Chemistry Award for distinguished young researchers.

Recensioner i media

"Outstandingly succeeds in its aim, it really is a magnificent work and every scientific ad medical library and group linked to the field should have a copy." (Current Engineering Practice, 2011) "The comprehensive listing of descriptors... is the actual strength of the book. Even experts in the field will find these sections helpful, because these are at the level of reviews." (ChemMedChem, 2010)"Outstandingly succeeds in its aim, it really is a magnificent work and every scientific ad medical library and group linked to the field should have a copy." (Current Engineering Practice, 2010)“This is an outstanding book, a book that will be appreciated by many, not only today and in the near future, as is the case with most scientific books, but for years to come. I would like without any hesitation to strongly recommend this book as an essential ‘instrument’ in all chemometrics laboratories all over the world.” (Journal of Chemical Information and Modeling, January 2010)

Innehållsförteckning

Volume I: ALPHABETICAL LISTING IntroductionHistorical PerspectiveQSAR/QSPR ModelingHow to Learn From This BookUsers GuideNotations and SymbolsAlphabetical Listing of approx. 3300 entriesGreek Alphabet EntriesNumerical Entries Volume II: APPENDICES, REFERENCES Full bibliography of more than 6000 references, selected from 450 journals and covering the period from the beginning of molecular descriptor research until the year 2008Greek alphabetsAcronymsMolecular structures