Search Results - "Serra, Jon R."

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  1. 1
    Generation of QSAR sets with a self-organizing map

    Generation of QSAR sets with a self-organizing map by Guha, Rajarshi, Serra, Jon R., Jurs, Peter C.

    Published in Journal of molecular graphics & modelling (01-09-2004)
    “…A Kohonen self-organizing map (SOM) is used to classify a data set consisting of dihydrofolate reductase inhibitors with the help of an external set of Dragon…”
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  2. 2
    The computational prediction of continuous and binary toxicological properties for organic molecules from molecular structure and the development of a novel set generation technique for quantitative structure-activity relationships and classification models

    The computational prediction of continuous and binary toxicological properties for organic molecules from molecular structure and the development of a novel set generation technique for quantitative structure-activity relationships and classification models by Serra, Jon R

    Published 01-01-2004
    “…This thesis presents the methodology and application of Quantitative Structure-Toxicity Relationships (QSTR). The goal of this work is to create predictive…”
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    Dissertation
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  3. 3
    The computational prediction of continuous and binary toxicological properties for organic molecules from molecular structure and the development of a novel set generation technique for quantitative structure -activity relationships and classification models

    The computational prediction of continuous and binary toxicological properties for organic molecules from molecular structure and the development of a novel set generation technique for quantitative structure -activity relationships and classification models by Serra, Jon R., Jr

    “…This thesis presents the methodology and application of Quantitative Structure-Toxicity Relationships (QSTR). The goal of this work is to create predictive…”
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    Dissertation
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