1.Stacked Multivariate Calibration Analysis
Chinese Journal of Analytical Chemistry 2010;38(3):367-371
Two novel algorithms that employed the idea of ensemble models(stacked generalization or stacked regression), stacked multivariate calibration(PCR and PLS) and stacked moving-window multivariate calibration(PCR and PLS), were reported. The proposed algorithms established parallel, conventional PCR or PLS models based on all intervals of a set of spectra to take advantage of the information from the whole spectrum. Unlike traditional methods, they stack or incorporate these parallel models in a way to emphasize intervals(regions) highly related to the target property. These two stacking algorithms generate more parsimonious regression models with better predictive power than that of conventional PCR and PLS, and perform best when the spectral information is neither isolated to a single, small region, nor spread uniformly over the spectral data. The predictive performance of these two new algorithms is similar. Thus, two real NIR spectra were used here to show the improvement in predictive performance from these two new algorithms.
2.Research of extracting and purifying taxol from the branches of Taxus media.
Liangjie QIAO ; Ruilin MAN ; Wangdong NI ; Yonghuang LIANG
China Journal of Chinese Materia Medica 2009;34(8):973-976
OBJECTIVEThe study was to explore extracting and purifying technology of taxol from the branches of Taxus media.
METHODIn extracting phase, the solvent extraction, ultrasonic extraction and the supercritical CO2 fluid extraction were studied respectively; In purifying phase, the extracts were disposed by silica gel column chromatography and preparation lamella chromatography, then crystaled by N-Hexane. The content of taxol was detected by HPLC.
RESULTThe results showed that the recovery of extracting toxal with the method of ultrasonic was the highest and the selectivity of supercritical CO2 fluid extraction was the best; The sample after being extracted should be purified two stages by silica gel column chromatography with dichloromethane-chloroform-methane (53:44:3) as elution and the lamella chromatography was chloroform-ethyl acetate-methane (88:7:5) as elution, finally we reached the fawn crystal.
CONCLUSIONIn that production, the content of taxol reached 87. 3% and the recovery 89.7%, which indicat that the taxol is well enrichment.
Chloroform ; chemistry ; Chromatography, High Pressure Liquid ; Chromatography, Supercritical Fluid ; Methane ; chemistry ; Methylene Chloride ; chemistry ; Paclitaxel ; chemistry ; isolation & purification ; Taxus ; chemistry
3.Diagnostic values of integrated evidence chain, Roussel Uclaf Causality Assessment Method, and Structured Expert Opinion Process method for drug-induced liver injury
Tingting HE ; Qingsheng LIANG ; Liping WANG ; Longxin LIANG ; Xiaohan LI ; Yanfei CUI ; Jing JING ; Zhaofang BAI ; Man GONG ; Ruilin WANG
Journal of Clinical Hepatology 2022;38(1):141-147
Objective To investigate the clinical applicability and different characteristics of three commonly used diagnostic methods for drug-induced liver injury from the two aspects of liver injury induced by Western medicine and liver injury induced by traditional Chinese medicine. Methods A prospective cohort study was performed for 289 hospitalized patients with acute drug-induced liver injury who were admitted to The Fifth Medical Center of Chinese PLA General Hospital from January 2015 to December 2020 and did not receive integrated traditional Chinese and Western medicine therapy, among whom 187 patients had herb-induced liver injury and 102 had Western medicine-induced liver injury. The 289 patients were diagnosed by the integrated evidence chain (IEC), Roussel Uclaf Causality Assessment Method (RUCAM), and the Structured Expert Opinion Process (SEOP) method, and related data at acute onset were collected, including general information, latency period, detailed medication, and laboratory markers such as alanine aminotransferase (ALT), aspartate aminotransferase (AST), gamma-glutamyl transpeptidase, alkaline phosphatase, and total bilirubin. A statistical analysis was performed to investigate the consistency between IEC, RUCAM, and SEOP in the diagnosis of Western medicine-induced liver injury and herb-induced liver injury and their own applicability. The Kruskal-Wallis H test was used for comparison of non-normally distributed continuous data; the chi-square was used for comparison of categorical data. Results The hepatocellular type was the main type of clinical liver injury in both Western medicine-induced liver injury and herb-induced liver injury, accounting for 81.4% and 74.3%, respectively, and laboratory examination showed higher levels of ALT and AST. Western medicine-induced liver injury cases were diagnosed by IEC, RUCAM, and SEOP, with a clinical diagnosis rate of 65.7%, 100%, and 63.7%, respectively, and the constituent ratio of Western medicine-induced liver injury was 23.2%, 35.3%, and 22.5%, respectively. Herb-induced liver injury cases were diagnosed by these three methods, with a clinical diagnosis rate of 47.6%, 100%, and 29.9%, respectively, and the constituent ratio of herb-induced liver injury was 30.8%, 64.7%, and 19.4%, respectively. The consistency test of the three diagnostic methods showed that in the diagnosis of Western medicine-induced liver injury cases, there was good consistency between IEC and SEOP (Kappa=0.785, P < 0.05), while there was poor consistency between RUCAM and IEC (Kappa=0.149, P > 0.05) and between RUCAM and SEOP (Kappa=0.117, P > 0.05); in the diagnosis of herb-induced liver injury cases, there was poor consistency between RUCAM and SEOP (Kappa=0.066, P > 0.05), while there was good consistency between RUCAM and IEC (Kappa=0.026, P < 0.05) and between IEC and SEOP (Kappa=0.437, P < 0.05). Conclusion The IEC method shows good applicability for both Western medicine-induced liver injury and herb-induced liver injury, and there is good consistency between IEC and SEOP in the diagnosis of Western medicine-induced liver injury cases, while there is a relatively low level of consistency between IEC and SEOP in the diagnosis of herb-induced liver injury. There is poor consistency between RUCAM and the other two methods. In the clinical diagnosis of Western medicine-induced liver injury, IEC, RUCAM, and SEOP should be used in combination to accurately judge the causal relationship between drugs and liver injury.