Application of GA-PLS and GA-KPLS calculations for the prediction of the retention indices of essential oils
[摘要] Genetic algorithm and partial least square (GA-PLS) and kernel PLS (GA-KPLS) techniques were used to investigate the correlation between retention indices (RI) and descriptors for 117 diverse compounds in essential oils from 5 Pimpinella species gathered from central Tur
[发布日期] [发布机构]
[效力级别] [学科分类] 化学(综合)
[关键词] essential oils;gas chromatography-mass spectrometry;QSRR. [时效性]