Computational chemistry methods: applications
This book reviews a variety of methods in computational chemistry and their applications in different fields of current research. Ab initio methods and regression analyses are discussed with special focus on their application to investigate chemical structures as for example dyes or drug compounds....
Gespeichert in:
| Weitere Verfasser: | |
|---|---|
| Format: | Elektronisch E-Book |
| Sprache: | English |
| Veröffentlicht: |
Berlin ; Boston
De Gruyter
[2020]
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| Schlagworte: | |
| Online-Zugang: | FAB01 FAW01 FCO01 FHA01 FKE01 FLA01 UPA01 Volltext |
| Zusammenfassung: | This book reviews a variety of methods in computational chemistry and their applications in different fields of current research. Ab initio methods and regression analyses are discussed with special focus on their application to investigate chemical structures as for example dyes or drug compounds. Further topics are the use of computational methods in the modeling of spectroscopic data or to study reaction mechanisms |
| Beschreibung: | Description based on online resource; title from PDF title page (publisher's Web site, viewed 26. Aug 2020) |
| Beschreibung: | 1 Online-Ressource (XIII, 181 Seiten) |
| ISBN: | 9783110631623 9783110629927 |
| DOI: | 10.1515/9783110631623 |
Internformat
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| 520 | |a This book reviews a variety of methods in computational chemistry and their applications in different fields of current research. Ab initio methods and regression analyses are discussed with special focus on their application to investigate chemical structures as for example dyes or drug compounds. Further topics are the use of computational methods in the modeling of spectroscopic data or to study reaction mechanisms | ||
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Datensatz im Suchindex
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| discipline | Chemie / Pharmazie |
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| doi_str_mv | 10.1515/9783110631623 |
| format | Electronic eBook |
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| id | DE-604.BV046887296 |
| illustrated | Not Illustrated |
| index_date | 2024-07-03T15:19:55Z |
| indexdate | 2024-07-10T08:56:36Z |
| institution | BVB |
| isbn | 9783110631623 9783110629927 |
| language | English |
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| oclc_num | 1197703734 |
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| physical | 1 Online-Ressource (XIII, 181 Seiten) |
| psigel | ZDB-23-DGG ZDB-23-DPC ZDB-23-DGG FAB_PDA_DGG ZDB-23-DGG FAW_PDA_DGG ZDB-23-DGG FCO_PDA_DGG ZDB-23-DGG FHA_PDA_DGG ZDB-23-DGG FKE_PDA_DGG ZDB-23-DGG FLA_PDA_DGG ZDB-23-DGG UPA_PDA_DGG |
| publishDate | 2020 |
| publishDateSearch | 2020 |
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| publisher | De Gruyter |
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| spelling | Computational chemistry methods applications edited by Ponnadurai Ramasami Berlin ; Boston De Gruyter [2020] © 2020 1 Online-Ressource (XIII, 181 Seiten) txt rdacontent c rdamedia cr rdacarrier Description based on online resource; title from PDF title page (publisher's Web site, viewed 26. Aug 2020) This book reviews a variety of methods in computational chemistry and their applications in different fields of current research. Ab initio methods and regression analyses are discussed with special focus on their application to investigate chemical structures as for example dyes or drug compounds. Further topics are the use of computational methods in the modeling of spectroscopic data or to study reaction mechanisms In English Ab-initio-Rechnung Computational Chemistry Modellierung SCIENCE / Chemistry / Computational & Molecular Modeling bisacsh Computational chemistry (DE-588)4290091-8 gnd rswk-swf Computational chemistry (DE-588)4290091-8 s DE-604 Ramasami, Ponnadurai 1969- (DE-588)118834997X edt Erscheint auch als Druck-Ausgabe 978-3-11-062906-4 https://doi.org/10.1515/9783110631623 Verlag URL des Erstveröffentlichers Volltext |
| spellingShingle | Computational chemistry methods applications Ab-initio-Rechnung Computational Chemistry Modellierung SCIENCE / Chemistry / Computational & Molecular Modeling bisacsh Computational chemistry (DE-588)4290091-8 gnd |
| subject_GND | (DE-588)4290091-8 |
| title | Computational chemistry methods applications |
| title_auth | Computational chemistry methods applications |
| title_exact_search | Computational chemistry methods applications |
| title_exact_search_txtP | Computational chemistry methods applications |
| title_full | Computational chemistry methods applications edited by Ponnadurai Ramasami |
| title_fullStr | Computational chemistry methods applications edited by Ponnadurai Ramasami |
| title_full_unstemmed | Computational chemistry methods applications edited by Ponnadurai Ramasami |
| title_short | Computational chemistry methods |
| title_sort | computational chemistry methods applications |
| title_sub | applications |
| topic | Ab-initio-Rechnung Computational Chemistry Modellierung SCIENCE / Chemistry / Computational & Molecular Modeling bisacsh Computational chemistry (DE-588)4290091-8 gnd |
| topic_facet | Ab-initio-Rechnung Computational Chemistry Modellierung SCIENCE / Chemistry / Computational & Molecular Modeling Computational chemistry |
| url | https://doi.org/10.1515/9783110631623 |
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