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  Computational Catalysis—Past, Present, and Future

Thiel, W. (2014). Computational Catalysis—Past, Present, and Future. Angewandte Chemie International Edition, 53(33), 8605-8613. doi:10.1002/anie.201402118.

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Item Permalink: https://hdl.handle.net/11858/00-001M-0000-0024-07AF-B Version Permalink: https://hdl.handle.net/11858/00-001M-0000-002C-1C2A-B
Genre: Journal Article

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 Creators:
Thiel, Walter1, Author           
Affiliations:
1Research Department Thiel, Max-Planck-Institut für Kohlenforschung, Max Planck Society, ou_1445590              

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Free keywords: biocatalysis; electronic structure; enantioselectivity; multiscale modeling; quantum chemistry
 Abstract: The explosive growth of computational catalysis over the past two decades is reflected by the exponentially increasing number of citations. The Essay traces the historical development, illustrates the current state, and offers comments on the future perspectives of this field.

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Language(s): eng - English
 Dates: 2014-02-052014-05-132014-08-11
 Publication Status: Issued
 Pages: 9
 Publishing info: -
 Table of Contents: -
 Rev. Type: Peer
 Identifiers: DOI: 10.1002/anie.201402118
 Degree: -

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Title: Angewandte Chemie International Edition
  Other : Angew. Chem., Int. Ed.
  Other : Angew. Chem. Int. Ed.
  Other : Angewandte Chemie, International Edition
Source Genre: Journal
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Publ. Info: Weinheim : Wiley-VCH
Pages: 9 Volume / Issue: 53 (33) Sequence Number: - Start / End Page: 8605 - 8613 Identifier: ISSN: 1433-7851
CoNE: https://pure.mpg.de/cone/journals/resource/1433-7851