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A new descriptor, SVEEVA (principal component scores vector of electronic eigenvalue descriptors), was derived from principal component analysis (PCA) of a matrix of 220 electronic eigenvalue descriptors of coded amino acids. SVEEVA scales were then applied in three panels of peptide quantitative structure-activity relationship (QSAR) that were modeled by(More)
A newly developed three-dimensional holographic vector of atomic interaction field (3D-HoVAIF) was used to describe the chemical structures of 28 arylamide derivatives as antituberculosis drug. Here, a quantitative structure activity relationship model was built by partial least square regression (PLS). The estimation stability and generalization ability of(More)
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