Testing the inter-operability of the CHARMM and SPC/Fw force-fields for conformational sampling Desmond, Jasmine L., Rodger, P. Mark and Walsh, Tiffany R. 2013, Testing the inter-operability of the CHARMM and SPC/Fw force-fields for conformational sampling, Molecular simulation, vol. 40, no. 12, pp. 912-921, doi: 10.1080/08927022.2013.824574. Attached Files Name Description MIMEType Size Downloads Title Testing the inter-operability of the CHARMM and SPC/Fw force-fields for conformational sampling Author(s) Desmond, Jasmine L. Rodger, P. Mark Walsh, Tiffany R. orcid.org/0000-0002-0233-9484 Journal name Molecular simulation Volume number 40 Issue number 12 Start page 912 End page 921 Total pages 10 Publisher Taylor & Francis Place of publication Abingdon, England Publication date 2013 ISSN 0892-7022 1029-0435 Keyword(s) force field biomolecule water replica exchange force field biomolecule water replica exchange Language eng DOI 10.1080/08927022.2013.824574 Field of Research 030406 Proteins and Peptides 030704 Statistical Mechanics in Chemistry Socio Economic Objective 970103 Expanding Knowledge in the Chemical Sciences HERDC Research category C1 Refereed article in a scholarly journal Copyright notice ©2013, Taylor & Francis Persistent URL http://hdl.handle.net/10536/DRO/DU:30057427 Document type: Journal Article Collection: Institute for Frontier Materials Related Links Link Description Connect to published version Go to link with your DU access privileges     Unless expressly stated otherwise, the copyright for items in DRO is owned by the author, with all rights reserved. Versions Version Filter Type Tue, 05 Nov 2013, 11:12:13 EST Wed, 06 Nov 2013, 14:11:22 EST Thu, 20 Mar 2014, 10:39:49 EST Thu, 20 Mar 2014, 10:40:32 EST Thu, 20 Mar 2014, 10:44:12 EST Wed, 23 Apr 2014, 10:07:28 EST Wed, 14 May 2014, 11:25:06 EST Fri, 13 Jun 2014, 18:37:36 EST Tue, 12 Aug 2014, 13:48:56 EST Tue, 12 Aug 2014, 13:50:32 EST Mon, 18 Aug 2014, 09:16:42 EST Tue, 18 Nov 2014, 14:26:27 EST Tue, 03 Feb 2015, 13:38:17 EST Wed, 14 Oct 2015, 13:36:31 EST Wed, 18 Nov 2015, 07:15:22 EST Mon, 29 Jan 2018, 12:43:28 EST Filtered Full Citation counts:   Cited 2 times in TR Web of Science Cited 2 times in Scopus Search Google Scholar Access Statistics: 255 Abstract Views, 4 File Downloads  -  Detailed Statistics Created: Tue, 05 Nov 2013, 11:12:13 EST

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