Eighty-three samples of mineral water from four di †erent wells in the same district were analysed for 23 parameters. Nineteen parameters were chosen for multivariate analysis. Principal components analysis provided a feature reduction to two or three dimensions without substantial loss of informati
Elucidating chemical reactivity by pattern recognition methods
✍ Scribed by J. Gasteiger; H. Saller; P. Löw
- Publisher
- Elsevier Science
- Year
- 1986
- Tongue
- English
- Weight
- 869 KB
- Volume
- 191
- Category
- Article
- ISSN
- 0003-2670
No coin nor oath required. For personal study only.
✦ Synopsis
Methods have been developed that allow important chemical effects to be quantified. Parameters calculated with these procedures can be used to investigate both quantitative and qualitative information on chemical reactivity. A variety of statistical and pattern recognition methods is used for that purpose. These studies lead to reactivity functions that allow the prediction of the course of complex organic reactions.
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