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<span class="title_page">References</span>
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<div id="tab_space_lateral"><a href="#sub_1" class="lnk_text">Toolbox reference</a></div>
<div id="tab_space_lateral"><a href="#sub_2" class="lnk_text">Useful paper</a></div>
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<span class="title_paragraph">_ Toolbox reference</span>
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MOLMAP multiway toolbox for MATLAB ver. 1.0, <br>
Milano Chemometrics and QSAR Research Group <br>
Dept. of Environmental Sciences -
University of Milano-Bicocca <br>
P.zza della Scienza, 1 -
20126 Milano
(Italy)<BR>
http://michem.disat.unimib.it/chm
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If you use this toolbox, preferably refer to:
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Ballabio D, Consonni V, Todeschini R. (<strong>2007</strong>) Classification of multiway analytical data based on MOLMAP approach. <em>Analytica Chimica Acta</em> <strong>in press</strong>, doi:10.1016/j.aca.2007.10.029<BR>
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<span class="title_paragraph">_ Useful paper</span>
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Paper on MOLMAP classification: <BR>
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Ballabio D, Consonni V, Todeschini R. (<strong>2007</strong>) Classification of multiway analytical data based on MOLMAP approach. <em>Analytica Chimica Acta </em> <strong>in press</strong>, doi:10.1016/j.aca.2007.10.029 <BR>
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Original papers on MOLMAP molecular descriptors are: <BR>
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Zhang QY, Aires-de-Sousa J. (<strong>2005</strong>) Structure-Based Classification of Chemical Reactions without Assignment of Reaction Centers. <em>Journal of Chemical Information and Modeling</em> <strong>45</strong> 1775-1783.
<BR><BR>Zhang QY, Aires-de-Sousa J. (<strong>2007</strong>) Random Forest Prediction of Mutagenicity from Empirical Physicochemical Descriptors. <em>Journal of Chemical Information and Modeling</em> <strong>47</strong> 1-8.<BR><BR>
Kohonen Maps of the <strong>MOLMAP multiway toolbox</strong> are based on this paper:<BR>
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Zupan J, Novic M, Ruisánchez I. (<strong>1997</strong>) Kohonen and counterpropagation artificial neural networks in analytical chemistry. <em>Chemometrics and Intelligent Laboratory Systems</em> <strong>38</strong> 1-23.<BR>
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