A pipeline for improved QSAR analysis of peptides: physiochemical property parameter selection via BMSF, near-neighbor sample selection via semivariogram, and weighted SVR regression and prediction

Wang, Lifeng; Chen, Yuan; Yuan, Zheming; Dai, Zhijun; Wang, Lifeng; Chen, Yuan; Bai, Lianyang; Yuan, Zheming; Wang, Haiyan; Bai, Lianyang; SCI

机构： Hunan Agr Univ, Hunan Prov Key Lab Germplasm Innovat & Utilizat C, Changsha, Hunan, Peoples R China; Hunan Agr Univ, Hunan Prov Key Lab Biol & Control Plant Dis & Ins, Changsha, Hunan, Peoples R China; Kansas State Univ, Dept Stat, Manhattan, KS 66506 USA; Hunan Acad Agr Sci, Changsha, Hunan, Peoples R China;

关键词： Peptides Quantitative structure-activity regression Feature selection Semivariogram Support vector regression