Metabolomics - CERM

Metabolomics - CERM Metabolomics - CERM

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METabolomic REFerence Convex hulls of 22 donors in the three most significant PCA PCA-CA CA dimensions PCA for data reduction CA for obtain well separated clusters KNN for classification 99% accuracy in montecarlo cross validation “natural” gender discrimination MALE FEMALE Assfalg, Bertini, Colangiuli, Luchinat, Schäfer, Schütz, Spraul, PNAS PNAS, , 2008 2008, , 105, 1420 1420-4

METabolomic REFerence Dendrogram of the 22 donors on the 21 21-dimensional dimensional PCA-CA PCA CA subspace Assfalg, Bertini, Colangiuli, Luchinat, Schäfer, Schütz, Spraul, PNAS PNAS, , 2008 2008, , 105, 1420 1420-4

METabolomic REFerence<br />

Convex hulls of 22 donors in the three most significant PCA PCA-CA CA dimensions<br />

PCA for data<br />

reduction<br />

CA for obtain<br />

well separated<br />

clusters<br />

KNN for<br />

classification<br />

99% accuracy<br />

in montecarlo<br />

cross validation<br />

“natural” gender discrimination<br />

MALE<br />

FEMALE<br />

Assfalg, Bertini, Colangiuli, Luchinat, Schäfer, Schütz, Spraul, PNAS PNAS, , 2008 2008, , 105, 1420 1420-4

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