Peak-finding partial least squares for the analysis of ¹H NMR spectra

Mathematics

• Nuclear Magnetic Resonance 100%
• Partial Least Squares 86%
• Principal Component Analysis 53%
• Linear Discriminant Analysis 45%
• Data Classification 24%
• Biological Tissue 24%
• Data Reduction 22%
• Amino Acids 22%
• Least Square Algorithm 21%
• Toxicity 21%
• Logistic Regression 18%
• Tumor 17%
• Monitoring 17%
• Efficient Algorithms 14%
• Evaluate 13%
• Class 4%

Engineering & Materials Science

• Nuclear magnetic resonance 79%
• Metabolites 68%
• Principal component analysis 46%
• Discriminant analysis 35%
• Choline 28%
• Tissue 28%
• Metabolomics 25%
• Amino acids 19%
• Toxicity 19%
• Data reduction 19%
• Molecular weight 18%
• Logistic regression 18%
• Tumors 17%
• Set theory 10%
• Monitoring 9%

Chemical Compounds

• 1H NMR Spectrum 59%
• Metabolite 47%
• Choline 24%
• Marker 19%
• Metabolic 18%
• NMR Spectroscopy 14%
• Weight 11%
• Reduction 10%
• Acid 7%