A new computer program for QSAR-analysis: ARTE-QSAR

نویسندگان

  • Sofie Van Damme
  • Patrick Bultinck
چکیده

A new computer program has been designed to build and analyze quantitative-structure activity relationship (QSAR) models through regression analysis. The user is provided with a range of regression and validation techniques. The emphasis of the program lies mainly in the validation of QSAR models in chemical applications. ARTE-QSAR produces an easy interpretable output from which the user can conclude if the obtained model is suitable for prediction and analysis.

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عنوان ژورنال:
  • Journal of computational chemistry

دوره 28 11  شماره 

صفحات  -

تاریخ انتشار 2007