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Dial-a-molecule workshop: computational prediction of reaction outcomes and optimum synthetic routes

Dial-a-molecule workshop: computational prediction of reaction outcomes and optimum synthetic routes
Dial-a-molecule workshop: computational prediction of reaction outcomes and optimum synthetic routes
Computational prediction of reaction outcomes and optimum synthetic routes was a two-day meeting and workshop organised by the EPSRC Dial-a-molecule grand challenge network. Forty delegates discussed computer predictions of synthetic routes and reactions, and considered their relevance to contemporary chemistry
computational, reaction prediction, optimisation, casd
1-3
Kilpin, Kelly J.
303b34ac-6db0-43e5-b1de-89c89b293d0f
Goodman, Jonathan M.
e5b4c6ee-935c-41d4-8389-5a8f7361a956
Johnson, A. Peter
42997db6-5610-4910-81e2-3c295f796df7
Whitby, Richard J.
45632236-ab00-4ad0-a02d-6209043e818b
Kilpin, Kelly J.
303b34ac-6db0-43e5-b1de-89c89b293d0f
Goodman, Jonathan M.
e5b4c6ee-935c-41d4-8389-5a8f7361a956
Johnson, A. Peter
42997db6-5610-4910-81e2-3c295f796df7
Whitby, Richard J.
45632236-ab00-4ad0-a02d-6209043e818b

Kilpin, Kelly J., Goodman, Jonathan M., Johnson, A. Peter and Whitby, Richard J. (2015) Dial-a-molecule workshop: computational prediction of reaction outcomes and optimum synthetic routes. Chemistry Central Journal, 9 (1), 1-3. (doi:10.1186/s13065-015-0129-9).

Record type: Article

Abstract

Computational prediction of reaction outcomes and optimum synthetic routes was a two-day meeting and workshop organised by the EPSRC Dial-a-molecule grand challenge network. Forty delegates discussed computer predictions of synthetic routes and reactions, and considered their relevance to contemporary chemistry

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s13065-015-0129-9.pdf - Version of Record
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More information

Accepted/In Press date: 10 September 2015
Published date: 23 September 2015
Keywords: computational, reaction prediction, optimisation, casd
Organisations: Chemistry

Identifiers

Local EPrints ID: 384096
URI: http://eprints.soton.ac.uk/id/eprint/384096
PURE UUID: 68c72533-a058-427d-97ce-c7d7c0b71400
ORCID for Kelly J. Kilpin: ORCID iD orcid.org/0000-0001-8829-7213
ORCID for Richard J. Whitby: ORCID iD orcid.org/0000-0002-9891-5502

Catalogue record

Date deposited: 04 Dec 2015 14:22
Last modified: 17 Dec 2019 02:04

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