Computer aided molecular design: theory and practice
CAMD or Computer Aided Molecular Design refers to the design of molecules with desirable properties. That is, through CAMD, one determines molecules that match a specified set of (target) properties. CAMD as a technique has a very large potential as in principle, all kinds of chemical, bio-chemical...
Saved in:
| Format: | Electronic eBook |
|---|---|
| Language: | English |
| Published: |
Amsterdam Boston
Elsevier
2003
|
| Edition: | 1st ed |
| Series: | Computer-aided chemical engineering
12 |
| Subjects: | |
| Online Access: | FLA01 Volltext Volltext |
| Summary: | CAMD or Computer Aided Molecular Design refers to the design of molecules with desirable properties. That is, through CAMD, one determines molecules that match a specified set of (target) properties. CAMD as a technique has a very large potential as in principle, all kinds of chemical, bio-chemical and material products can be designed through this technique. This book mainly deals with macroscopic properties and therefore does not cover molecular design of large, complex chemicals such as drugs. While books have been written on computer aided molecular design relating to drugs and large complex chemicals, a book on systematic formulation of CAMD problems and solutions, with emphasis on theory and practice, which helps one to learn, understand and apply the technique is currently unavailable. This title brings together the theoretical aspects related to Computer Aided Molecular Design, the different techniques that have been developed and the different applications that have been reported. Contributing authors are among the leading researchers and users of CAMD First book available giving a systematic formulation of CAMD problems and solutions |
| Item Description: | Includes bibliographical references and indexes |
| Physical Description: | 1 online resource (x, 392 pages) illustrations |
| ISBN: | 9780444512833 0444512837 9780080529431 0080529437 |
Staff View
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| id | DE-604.BV046124029 |
| illustrated | Illustrated |
| indexdate | 2024-07-10T08:35:49Z |
| institution | BVB |
| isbn | 9780444512833 0444512837 9780080529431 0080529437 |
| language | English |
| oai_aleph_id | oai:aleph.bib-bvb.de:BVB01-031504481 |
| oclc_num | 162579518 |
| open_access_boolean | |
| physical | 1 online resource (x, 392 pages) illustrations |
| psigel | ZDB-33-ESD ZDB-33-ESD FLA_PDA_ESD |
| publishDate | 2003 |
| publishDateSearch | 2003 |
| publishDateSort | 2003 |
| publisher | Elsevier |
| record_format | marc |
| series2 | Computer-aided chemical engineering |
| spelling | Computer aided molecular design theory and practice edited by Luke E.K. Achenie, Rafiqul Gani, Venkat Venkatasubramanian 1st ed Amsterdam Boston Elsevier 2003 1 online resource (x, 392 pages) illustrations txt rdacontent c rdamedia cr rdacarrier Computer-aided chemical engineering 12 Includes bibliographical references and indexes CAMD or Computer Aided Molecular Design refers to the design of molecules with desirable properties. That is, through CAMD, one determines molecules that match a specified set of (target) properties. CAMD as a technique has a very large potential as in principle, all kinds of chemical, bio-chemical and material products can be designed through this technique. This book mainly deals with macroscopic properties and therefore does not cover molecular design of large, complex chemicals such as drugs. While books have been written on computer aided molecular design relating to drugs and large complex chemicals, a book on systematic formulation of CAMD problems and solutions, with emphasis on theory and practice, which helps one to learn, understand and apply the technique is currently unavailable. This title brings together the theoretical aspects related to Computer Aided Molecular Design, the different techniques that have been developed and the different applications that have been reported. Contributing authors are among the leading researchers and users of CAMD First book available giving a systematic formulation of CAMD problems and solutions SCIENCE / Chemistry / Physical & Theoretical bisacsh Molecular structure / Data processing fast Molecules / Models / Data processing fast Estrutura molecular (química teórica) larpcal Molécula (processamento de dados) larpcal Molecular structure Data processing Molecules Models Data processing Achenie, Luke E. K. Sonstige oth Gani, R. Sonstige oth Venkatasubramanian, Venkat Sonstige oth http://www.sciencedirect.com/science/book/9780444512833 Verlag URL des Erstveröffentlichers Volltext http://www.sciencedirect.com/science/bookseries/15707946/12 Verlag URL des Erstveröffentlichers Volltext |
| spellingShingle | Computer aided molecular design theory and practice SCIENCE / Chemistry / Physical & Theoretical bisacsh Molecular structure / Data processing fast Molecules / Models / Data processing fast Estrutura molecular (química teórica) larpcal Molécula (processamento de dados) larpcal Molecular structure Data processing Molecules Models Data processing |
| title | Computer aided molecular design theory and practice |
| title_auth | Computer aided molecular design theory and practice |
| title_exact_search | Computer aided molecular design theory and practice |
| title_full | Computer aided molecular design theory and practice edited by Luke E.K. Achenie, Rafiqul Gani, Venkat Venkatasubramanian |
| title_fullStr | Computer aided molecular design theory and practice edited by Luke E.K. Achenie, Rafiqul Gani, Venkat Venkatasubramanian |
| title_full_unstemmed | Computer aided molecular design theory and practice edited by Luke E.K. Achenie, Rafiqul Gani, Venkat Venkatasubramanian |
| title_short | Computer aided molecular design |
| title_sort | computer aided molecular design theory and practice |
| title_sub | theory and practice |
| topic | SCIENCE / Chemistry / Physical & Theoretical bisacsh Molecular structure / Data processing fast Molecules / Models / Data processing fast Estrutura molecular (química teórica) larpcal Molécula (processamento de dados) larpcal Molecular structure Data processing Molecules Models Data processing |
| topic_facet | SCIENCE / Chemistry / Physical & Theoretical Molecular structure / Data processing Molecules / Models / Data processing Estrutura molecular (química teórica) Molécula (processamento de dados) Molecular structure Data processing Molecules Models Data processing |
| url | http://www.sciencedirect.com/science/book/9780444512833 http://www.sciencedirect.com/science/bookseries/15707946/12 |
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