Applied chemoinformatics : (Record no. 79145)
[ view plain ]
| 000 -LEADER | |
|---|---|
| fixed length control field | 05353cam a2200517Ii 4500 |
| 001 - CONTROL NUMBER | |
| control field | on1031999560 |
| 003 - CONTROL NUMBER IDENTIFIER | |
| control field | OCoLC |
| 005 - DATE AND TIME OF LATEST TRANSACTION | |
| control field | 20201009115345.0 |
| 006 - FIXED-LENGTH DATA ELEMENTS--ADDITIONAL MATERIAL CHARACTERISTICS | |
| fixed length control field | m o d |
| 007 - PHYSICAL DESCRIPTION FIXED FIELD--GENERAL INFORMATION | |
| fixed length control field | cr |n||||||||| |
| 008 - FIXED-LENGTH DATA ELEMENTS--GENERAL INFORMATION | |
| fixed length control field | 180423s2018 gw ob 001 0 eng d |
| 040 ## - CATALOGING SOURCE | |
| Original cataloging agency | N$T |
| Language of cataloging | eng |
| Description conventions | rda |
| -- | pn |
| Transcribing agency | N$T |
| Modifying agency | DG1 |
| -- | N$T |
| -- | UAB |
| -- | UPM |
| -- | CNCGM |
| -- | OCLCF |
| -- | OCLCQ |
| -- | RECBK |
| -- | MERER |
| -- | OCLCQ |
| -- | CDN |
| -- | WYU |
| 020 ## - INTERNATIONAL STANDARD BOOK NUMBER | |
| International Standard Book Number | 9783527806522 |
| Qualifying information | (electronic bk.) |
| 020 ## - INTERNATIONAL STANDARD BOOK NUMBER | |
| International Standard Book Number | 3527806520 |
| Qualifying information | (electronic bk.) |
| 020 ## - INTERNATIONAL STANDARD BOOK NUMBER | |
| International Standard Book Number | 9783527806539 |
| Qualifying information | (electronic bk.) |
| 020 ## - INTERNATIONAL STANDARD BOOK NUMBER | |
| International Standard Book Number | 3527806539 |
| Qualifying information | (electronic bk.) |
| 020 ## - INTERNATIONAL STANDARD BOOK NUMBER | |
| International Standard Book Number | 9783527806546 |
| Qualifying information | (electronic bk.) |
| 020 ## - INTERNATIONAL STANDARD BOOK NUMBER | |
| International Standard Book Number | 3527806547 |
| Qualifying information | (electronic bk.) |
| 020 ## - INTERNATIONAL STANDARD BOOK NUMBER | |
| Canceled/invalid ISBN | 9783527342013 |
| 029 1# - OTHER SYSTEM CONTROL NUMBER (OCLC) | |
| OCLC library identifier | CHVBK |
| System control number | 516430556 |
| 029 1# - OTHER SYSTEM CONTROL NUMBER (OCLC) | |
| OCLC library identifier | CHNEW |
| System control number | 001003294 |
| 029 1# - OTHER SYSTEM CONTROL NUMBER (OCLC) | |
| OCLC library identifier | GBVCP |
| System control number | 102730818X |
| 035 ## - SYSTEM CONTROL NUMBER | |
| System control number | (OCoLC)1031999560 |
| 050 #4 - LIBRARY OF CONGRESS CALL NUMBER | |
| Classification number | QD39.3.E46 |
| Item number | A66 2018eb |
| 072 #7 - SUBJECT CATEGORY CODE | |
| Subject category code | SCI |
| Subject category code subdivision | 013020 |
| Source | bisacsh |
| 082 04 - DEWEY DECIMAL CLASSIFICATION NUMBER | |
| Classification number | 542/.85 |
| Edition number | 23 |
| 049 ## - LOCAL HOLDINGS (OCLC) | |
| Holding library | MAIN |
| 245 00 - TITLE STATEMENT | |
| Title | Applied chemoinformatics : |
| Remainder of title | achievements and future opportunities / |
| Statement of responsibility, etc. | edited by Thomas Engel and Johann Gasteiger. |
| 264 #1 - PRODUCTION, PUBLICATION, DISTRIBUTION, MANUFACTURE, AND COPYRIGHT NOTICE | |
| Place of production, publication, distribution, manufacture | Weinheim, Germany : |
| Name of producer, publisher, distributor, manufacturer | Wiley-VCH, |
| Date of production, publication, distribution, manufacture, or copyright notice | [2018] |
| 300 ## - PHYSICAL DESCRIPTION | |
| Extent | 1 online resource (xxvi, 617 pages) |
| 336 ## - CONTENT TYPE | |
| Content type term | text |
| Content type code | txt |
| Source | rdacontent |
| 337 ## - MEDIA TYPE | |
| Media type term | computer |
| Media type code | c |
| Source | rdamedia |
| 338 ## - CARRIER TYPE | |
| Carrier type term | online resource |
| Carrier type code | cr |
| Source | rdacarrier |
| 588 0# - SOURCE OF DESCRIPTION NOTE | |
| Source of description note | Online resource; title from PDF title page (EBSCO, viewed April 24, 2018) |
| 505 0# - FORMATTED CONTENTS NOTE | |
| Formatted contents note | Introduction / Thomas Engel, Johann Gasteiger -- QSAR/QSPR / Wolfgang Sippl, Dina Robaa -- Prediction of Physicochemical Properties of Compounds / Igor V Tetko, Aixia Yan, Johann Gasteiger -- Chemical Reactions -- Chemical Reactions. Chemical Reactions - An Introduction / Johann Gasteiger -- Reaction Prediction and Synthesis Design / Jonathan M Goodman -- Explorations into Biochemical Pathways / Oliver Sacher, Johann Gasteiger -- Structure-Spectrum Correlations and Computer-Assisted Structure Elucidation / Joao Aires de Sousa -- Drug Discovery: An Overview / Lothar Terfloth, Simon Spycher, Johann Gasteiger -- Bridging Information on Drugs, Targets, and Diseases / Andreas Steffen, Bertram Weiss -- Chemoinformatics in Natural Product Research / Teresa Kaserer, Daniela Schuster, Judith M Rollinger -- Chemoinformatics of Chinese Herbal Medicines / Jun Xu -- PubChem / Wolf-D Ihlenfeldt -- Pharmacophore Perception and Applications / Thomas Seidel, Gerhard Wolber, Manuela S Murgueitio -- Prediction, Analysis, and Comparison of Active Sites / Andrea Volkamer, Mathias M Behren, Stefan Bietz, Matthias Rarey -- Structure-Based Virtual Screening / Adrian Kolodzik, Nadine Schneider, Matthias Rarey -- Prediction of ADME Properties / Aixia Yan -- Prediction of Xenobiotic Metabolism / Anthony Long, Ernest Murray -- Chemoinformatics at the CADD Group of the National Cancer Institute / Megan L Peach, Marc C Nicklaus -- Uncommon Data Sources for QSAR Modeling / Alexander Tropsha -- Future Perspectives of Computational Drug Design / Gisbert Schneider -- Computational Approaches in Agricultural Research / Klaus-Jürgen Schleifer -- Chemoinformatics in Modern Regulatory Science / Chihae Yang, James F Rathman, Aleksey Tarkhov, Oliver Sacher, Thomas Kleinoeder, Jie Liu, Thomas Magdziarz, Aleksandra Mostraq, Joerg Marusczyk, Darshan Mehta, Christof Schwab, Bruno Bienfait -- Chemometrics in Analytical Chemistry / Anita Rácz, Dávid Bajusz, Károly Héberger -- Chemoinformatics in Food Science / Andrea Peña-Castillo, Oscar Méndez-Lucio, John R Owen, Karina Martínez-Mayorga, José L Medina-Franco -- Computational Approaches to Cosmetics Products Discovery / Soheila Anzali, Frank Pflücker, Lilia Heider, Alfred Jonczyk -- Applications in Materials Science / Tu C Le, David A Winkler -- Process Control and Soft Sensors / Kimito Funatsu -- Future Directions / Johann Gasteiger. |
| 504 ## - BIBLIOGRAPHY, ETC. NOTE | |
| Bibliography, etc. note | Includes bibliographical references and index. |
| 520 8# - SUMMARY, ETC. | |
| Summary, etc. | Annotation |
| Expansion of summary note | Edited by world-famous pioneers in chemoinformatics, this is a clearly structured and application-oriented approach to the topic, providing up-to-date and focused information on the range of applications in this exciting field. The authors explain methods and software tools, such that users will not only learn the basics but also how to use the different software packages available, including tools for correct data interpretation and structure simulation, right up to computer-guided library design for medicinal chemistry. They also describe applications in such different fields as structure spectra correlations, virtual screening, prediction of active sites, library design, and toxicity modelling. The book is aimed at advanced students as well as lecturers, but also at application-oriented scientists wishing to acquire the skills needed to benefit from a simplified workflow via chemoinformatics. Together with the corresponding textbook "Chemoinformatics - A Textbook Bridging to Bioinformatics" on the fundamentals of chemoinformatics readers will have a comprehensive overview of the field. |
| 650 #0 - SUBJECT ADDED ENTRY--TOPICAL TERM | |
| Topical term or geographic name entry element | Cheminformatics. |
| 650 #7 - SUBJECT ADDED ENTRY--TOPICAL TERM | |
| Topical term or geographic name entry element | SCIENCE / Chemistry / Clinical. |
| Source of heading or term | bisacsh |
| 650 #7 - SUBJECT ADDED ENTRY--TOPICAL TERM | |
| Topical term or geographic name entry element | Cheminformatics. |
| Source of heading or term | fast |
| Authority record control number or standard number | (OCoLC)fst00853337 |
| 655 #4 - INDEX TERM--GENRE/FORM | |
| Genre/form data or focus term | Electronic books. |
| 700 1# - ADDED ENTRY--PERSONAL NAME | |
| Personal name | Engel, Thomas, |
| Titles and other words associated with a name | Dr., |
| Relator term | editor. |
| 700 1# - ADDED ENTRY--PERSONAL NAME | |
| Personal name | Gasteiger, J. |
| Fuller form of name | (Johann), |
| Relator term | editor. |
| 856 40 - ELECTRONIC LOCATION AND ACCESS | |
| Uniform Resource Identifier | <a href="https://doi.org/10.1002/9783527806539">https://doi.org/10.1002/9783527806539</a> |
| Public note | Wiley Online Library |
| 994 ## - | |
| -- | 92 |
| -- | DG1 |
No items available.