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I reckon you are looking at a scientific software which can help you do both....infact we are using a software package called as The Unscrambler and i would suggest you try it .It helps you do PCA, PLS , MCR etc with ease ...I have even heard about many other software packages but havn't really used them so cant really comment on those...

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Q: Which is the best software for multivariate data analysis and experimental design?
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