Concordance

{
  "id": "MLC-T-CHM-002378",
  "term": "Concordance",
  "field": "Chemistry",
  "definition": "The agreement between a predicted property and an experimentally measured value for a set of chemical compounds. In computational drug design, this measures how well a model, such as a quantitative structure-activity relationship (QSAR) model, reproduces observed biological activities or physicochemical properties. Concordance is quantified using statistical metrics like the coefficient of determination (R²) or by analyzing the percentage of compounds correctly classified as active or inactive.",
  "subject": "Chemistry and Human Health",
  "references": [
    "PAC, 2016, 88, 239. 'Glossary of terms used in computational drug design, part II (IUPAC Recommendations 2015)' on page 244 (https://doi.org/10.1515/pac-2012-1204)"
  ],
  "url": "https://mlchart.com/terminology/chemistry/concordance/"
}