MLchartDataset catalogue

Partial least squares

Term · Chemistry · MLC-T-CHM-008490

A statistical method that relates a set of predictor variables to a set of response variables by projecting them onto a new set of latent variables. It is particularly useful when there are many predictor variables, multicollinearity among them, or when the number of predictors exceeds the number of observations. This technique is widely used in chemometrics for quantitative structure-activity relationship (QSAR) modeling.

Table 1. Record
IdentifierMLC-T-CHM-008490
FieldChemistry
SubjectChemistry and Human Health
ReferencesPAC, 1997, 69, 1137. 'Glossary of terms used in computational drug design (IUPAC Recommendations 1997)' on page 1148 (https://doi.org/10.1351/pac199769051137)
Record as JSON
{
  "id": "MLC-T-CHM-008490",
  "term": "Partial least squares",
  "field": "Chemistry",
  "definition": "A statistical method that relates a set of predictor variables to a set of response variables by projecting them onto a new set of latent variables. It is particularly useful when there are many predictor variables, multicollinearity among them, or when the number of predictors exceeds the number of observations. This technique is widely used in chemometrics for quantitative structure-activity relationship (QSAR) modeling.",
  "subject": "Chemistry and Human Health",
  "references": [
    "PAC, 1997, 69, 1137. 'Glossary of terms used in computational drug design (IUPAC Recommendations 1997)' on page 1148 (https://doi.org/10.1351/pac199769051137)"
  ],
  "url": "https://mlchart.com/terminology/chemistry/partial-least-squares/"
}

Record 9,018 of 13,676 in Chemistry terminology (MLC-0109). Request the full dataset.