A General Guidebook for the Theoretical Prediction of Physicochemical Properties of Chemicals for Regulatory Purposes
2015; American Chemical Society; Volume: 115; Issue: 24 Linguagem: Inglês
10.1021/acs.chemrev.5b00215
ISSN1520-6890
AutoresCarlos Nieto‐Draghi, Guillaume Fayet, Benoît Creton, Xavier Rozanska, Patricia Rotureau, Jean-Charles de Hemptinne, Philippe Ungerer, B. Rousseau, Carlo Adamo,
Tópico(s)Thermal and Kinetic Analysis
ResumoADVERTISEMENT RETURN TO ISSUEPREVReviewNEXTA General Guidebook for the Theoretical Prediction of Physicochemical Properties of Chemicals for Regulatory PurposesCarlos Nieto-Draghi*†, Guillaume Fayet‡, Benoit Creton†, Xavier Rozanska§, Patricia Rotureau‡, Jean-Charles de Hemptinne†, Philippe Ungerer§, Bernard Rousseau∥, and Carlo Adamo⊥#View Author Information† IFP Energies nouvelles, 1 et 4 avenue de Bois-Préau, 92852 Rueil-Malmaison, France‡ INERIS, Parc Technologique Alata, BP2, 60550 Verneuil-en-Halatte, France§ Materials Design S.A.R.L., 18, rue de Saisset, 92120 Montrouge, France∥ Laboratoire de Chimie-Physique, Université Paris Sud, UMR 8000 CNRS, Bât. 349, 91405 Orsay Cedex, France⊥ Institut de Recherche Chimie Paris, PSL Research University, CNRS, Chimie Paristech, 11 rue P. et M. Curie, F-75005 Paris, France# Institut Universitaire de France, 103 Boulevard Saint Michel, F-75005 Paris, France*E-mail: [email protected]Cite this: Chem. Rev. 2015, 115, 24, 13093–13164Publication Date (Web):December 1, 2015Publication History Received7 May 2015Published online1 December 2015Published inissue 23 December 2015https://pubs.acs.org/doi/10.1021/acs.chemrev.5b00215https://doi.org/10.1021/acs.chemrev.5b00215review-articleACS PublicationsCopyright © 2015 American Chemical SocietyRequest reuse permissionsArticle Views5383Altmetric-Citations115LEARN ABOUT THESE METRICSArticle Views are the COUNTER-compliant sum of full text article downloads since November 2008 (both PDF and HTML) across all institutions and individuals. These metrics are regularly updated to reflect usage leading up to the last few days.Citations are the number of other articles citing this article, calculated by Crossref and updated daily. Find more information about Crossref citation counts.The Altmetric Attention Score is a quantitative measure of the attention that a research article has received online. Clicking on the donut icon will load a page at altmetric.com with additional details about the score and the social media presence for the given article. Find more information on the Altmetric Attention Score and how the score is calculated. Share Add toView InAdd Full Text with ReferenceAdd Description ExportRISCitationCitation and abstractCitation and referencesMore Options Share onFacebookTwitterWechatLinked InRedditEmail Other access optionsGet e-AlertscloseSupporting Info (1)»Supporting Information Supporting Information SUBJECTS:Chromatography,Liquids,Molecular modeling,Molecules,Quantitative structure property relationship Get e-Alerts
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