Published: Geven Piir (2020-04-30)
Abstract: Quantitative structure–property relationships represent a powerful method alternative to experiments to access the estimation of physico-chemical properties of chemical substances. Such predictions are useful for screening purpose at R&D level. Moreover, this approach is encouraged by the REACH regulation for the collection of data when used cleanly and ...
PhysChem Regression DescriptorCalculation QMRF