Quantification

量化
  • 文章类型: Journal Article
    这项研究解决了全球对城市废物管理日益增长的担忧,特别是在大瓜亚基尔都市区(GGA)等城市。通过对就地生活垃圾产生和地理信息系统(GIS)工具的实际实地研究,这项工作提供了一个框架来预测拉丁美洲任何大都市地区可回收生活垃圾的数量和类型。超过4周,学生收集,分类和称重可回收废物类型,包括塑料,paper,金属,玻璃和织物,来自GGA的776个抽样家庭。ArcGIS调查工具确定了家庭位置,并允许调查不同的社会人口统计特征。借助ArcGIS插值法,预测了GGA的家庭垃圾总产生量,不同类型的可回收废物的分类也在空间上分布在研究区域。该报告指出了塑料废物的显着趋势,特别是聚对苯二甲酸乙二醇酯废物的稳定流行和42%的增长率,强调加强回收技术的重要性。空间密度图显示整个GGA的废物分布不均,强调废物输出较高的地点。这项研究表明,通过与学术界合作克服知识差距,可以以适度廉价的支出来改善可回收废物收集。这一战略为减轻废物管理不善对环境的影响提供了机会。
    This study tackles the growing global concern about municipal waste management, particularly in cities like the Grand Guayaquil Metropolitan Area (GGA). Through realistic field studies on in situ household waste generation and geographic information system (GIS) tools, this work offers a framework to predict the quantities and types of recyclable household waste for any metropolitan area in Latin America. Over 4 weeks, students collected, sorted and weighed recyclable waste types, including plastic, paper, metal, glass and fabric, from 776 sampled household of the GGA. ArcGIS survey tool identified household locations and allowed to survey different socio-demographic features. With the help of ArcGIS interpolation method, the total household waste generation for GGA was predicted, and the classification of the different types of recyclable waste was also spatially distributed for the study area. The report identified notable trends in plastic waste, specifically polyethylene terephthalate waste\'s steady prevalence and 42% growth rate, emphasizing the importance of enhanced recycling techniques. Spatial density maps showed a heterogeneous waste distribution across the GGA, emphasizing locations with higher waste output. This study demonstrates that improving recyclable waste collection can be accomplished with a moderately cheap expenditure by collaborating with academia to overcome knowledge gaps. This strategy provides opportunities to mitigate the environmental impacts of poor waste management.
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  • 文章类型: Journal Article
    该研究旨在开发老年男性盆底和大腿的有限元模型,以定量评估不同盆底肌肉训练的影响以及泌尿和排便控制能力。
    基于MRI和CT构建了老年男性盆底和大腿的有限元模型。盆底组织的材料特性通过文献综述,以及腰围的相对变化,后膀胱角度(RVA)和非直肠角度(ARA)定量验证了模型的有效性。通过改变肌肉的物质特性,该研究分析了五种康复训练对四种排尿排便功能障碍的肌肉增强或损伤效果。四个结果指标的变化,包括后膀胱角度,非矩形角度,压力,和应变,进行了比较。
    这项研究表明,随着材料性能的变化,ARA和RVA接近其正常范围,表明泌尿和排便控制能力增强,特别是通过有针对性的肛提肌锻炼,肛门外括约肌,和盆底肌肉.这项研究还强调了个性化康复计划的有效性,包括生物反馈,运动训练,电刺激,磁刺激,和振动训练,并倡导为老年患者提供优化的康复训练方法。
    基于计算生物力学的结果,本研究为老年人排尿和排便控制能力的康复训练提供了基础性的科学见解和实践建议,从而提高他们的生活质量。此外,本研究还提供了有限元分析在老年男性中的新观点和潜在应用,特别是在评估和设计有针对性的康复训练。
    UNASSIGNED: The study aims to develop a finite element model of the pelvic floor and thighs of elderly men to quantitatively assess the impact of different pelvic floor muscle trainings and the urinary and defecation control ability.
    UNASSIGNED: A finite element model of the pelvic floor and thighs of elderly men was constructed based on MRI and CT. Material properties of pelvic floor tissues were assigned through literature review, and the relative changes in waistline, retrovesical angle (RVA) and anorectad angulation (ARA) to quantitatively verify the effectiveness of the model. By changing the material properties of muscles, the study analyzed the muscle strengthening or impairment effects of the five types of rehabilitation training for four types of urination and defecation dysfunction. The changes in four outcome indicators, including the retrovesical angle, anorectad angulation, stress, and strain, were compared.
    UNASSIGNED: This study indicates that ARA and RVA approached their normal ranges as material properties changed, indicating an enhancement in the urinary and defecation control ability, particularly through targeted exercises for the levator ani muscle, external anal sphincter, and pelvic floor muscles. This study also emphasizes the effectiveness of personalized rehabilitation programs including biofeedback, exercise training, electrical stimulation, magnetic stimulation, and vibration training and advocates for providing optimized rehabilitation training methods for elderly patients.
    UNASSIGNED: Based on the results of computational biomechanics, this study provides foundational scientific insights and practical recommendations for rehabilitation training of the elderly\'s urinary and defecation control ability, thereby improving their quality of life. In addition, this study also provides new perspectives and potential applications of finite element analysis in elderly men, particularly in evaluating and designing targeted rehabilitation training.
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  • 文章类型: Journal Article
    超声由于其安全性而广泛用于肌腱评估,负担能力,和便携性,但它的主观性带来了挑战。本研究旨在开发一种基于人工智能的新定量分析工具,以识别健康和病理肌腱的统计模式。此外,我们的目标是通过将它与专家的主观评估进行比较来验证这个新工具。建立了一个包含健康对照和髌腱病患者的试点数据库,涉及14名无症状(n=7)和有症状(n=7)髌骨肌腱的参与者。超声图像被评估两次,利用新的定量工具和专家在五个感兴趣的区域应用的主观评分方法。数据库每个图像包含61个变量。通过可靠性分析来测试临床和定量评估的稳健性。最后,通过交叉验证的广义线性混合效应逻辑回归检验了定量特征的预测准确性.这些分析显示了与“骨骼”和“质量”相关的定量变量的高可靠性,ICC高于0.75。“边缘”和“厚度”的ICC变化,但大多超过0.75。这项研究的结果表明,某些定量变量能够预测具有通常较高的交叉验证AUC评分的专家的主观评估。设计了一种用于肌腱超声检查的新定量工具。该系统被证明是评估髌腱结构的可靠和有效的方法。
    Ultrasound is widely used for tendon assessment due to its safety, affordability, and portability, but its subjective nature poses challenges. This study aimed to develop a new quantitative analysis tool based on artificial intelligence to identify statistical patterns of healthy and pathological tendons. Furthermore, we aimed to validate this new tool by comparing it to experts\' subjective assessments. A pilot database including healthy controls and patients with patellar tendinopathy was constructed, involving 14 participants with asymptomatic (n = 7) and symptomatic (n = 7) patellar tendons. Ultrasonographic images were assessed twice, utilizing both the new quantitative tool and the subjective scoring method applied by an expert across five regions of interest. The database contained 61 variables per image. The robustness of the clinical and quantitative assessments was tested via reliability analyses. Lastly, the prediction accuracy of the quantitative features was tested via cross-validated generalized linear mixed-effects logistic regressions. These analyses showed high reliability for quantitative variables related to \"Bone\" and \"Quality\", with ICCs above 0.75. The ICCs for \"Edges\" and \"Thickness\" varied but mostly exceeded 0.75. The results of this study show that certain quantitative variables are capable of predicting an expert\'s subjective assessment with generally high cross-validated AUC scores. A new quantitative tool for the ultrasonographic assessment of the tendon was designed. This system is shown to be a reliable and valid method for evaluating the patellar tendon structure.
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  • 文章类型: Journal Article
    目的:高分辨率对比增强血管壁MRI(VWMRI)上的动脉瘤壁增强(AWE)是颅内动脉瘤(IA)稳定性的新兴生物标志物。文献中AWE的量化方法,然而,是可变的。我们旨在确定最佳的对比后时机,以量化囊状和梭状IAs中的AWE。
    方法:前瞻性招募连续未破裂IAs患者。在1个对比前阶段和4个连续对比后阶段(每个阶段为9分钟)获得VWMRI。测量对比前和对比后4个阶段的脑脊液(CSF)和动脉瘤壁的信号强度值,以确定动脉瘤壁增强指数(WEI)。还使用先前的分级标准在对比后图像上对AWE进行了定性分析。分析了囊状和梭形IAs的AWE等级和WEI的动态变化。
    结果:纳入了34例42个IAs患者(27个囊状IAs和15个梭形IAs)。在4个对比后阶段,AWE等级的变化发生在8个(30%)囊状IA和6个(40%)梭状IA中。对比增强后,梭形IAs的WEI随时间下降了22.0%(p=0.009),而囊状IAs的WEI在4个对比后阶段保持恒定(p>0.05)。
    结论:对AWE进行定量分析时,造影剂注射后立即获得造影剂后VWMRI,对于梭形IAs而言,AWE最强。对于囊状IAs,造影剂注射后AWE度稳定36分钟。
    结论:AWE的成像方案和分析方法的标准化将有助于未破裂IAs患者的影像学监测和进一步的治疗决策。
    结论:颅内动脉瘤壁增强的成像方案和测量结果是不均匀的。对于梭状颅内动脉瘤(IAs),动脉瘤壁增强在造影后立即最强,囊状IAs稳定36分钟。未来的多中心研究应研究动脉瘤壁增强作为动脉瘤生长和破裂的新兴标志物。
    OBJECTIVE: Aneurysm wall enhancement (AWE) on high-resolution contrast-enhanced vessel wall MRI (VWMRI) is an emerging biomarker for intracranial aneurysms (IAs) stability. Quantification methods of AWE in the literature, however, are variable. We aimed to determine the optimal post-contrast timing to quantify AWE in both saccular and fusiform IAs.
    METHODS: Consecutive patients with unruptured IAs were prospectively recruited. VWMRI was acquired on 1 pre-contrast and 4 consecutive post-contrast phases (each phase was 9 min). Signal intensity values of cerebrospinal fluid (CSF) and aneurysm wall on pre- and 4 post-contrast phases were measured to determine the aneurysm wall enhancement index (WEI). AWE was also qualitatively analyzed on post-contrast images using previous grading criteria. The dynamic changes of AWE grade and WEI were analyzed for both saccular and fusiform IAs.
    RESULTS: Thirty-four patients with 42 IAs (27 saccular IAs and 15 fusiform IAs) were included. The changes in AWE grade occurred in 8 (30%) saccular IAs and 6 (40%) in fusiform IAs during the 4 post-contrast phases. The WEI of fusiform IAs decreased 22.0% over time after contrast enhancement (p = 0.009), while the WEI of saccular IAs kept constant during the 4 post-contrast phases (p > 0.05).
    CONCLUSIONS: When performing quantitative analysis of AWE, acquiring post-contrast VWMRI immediately after contrast injection achieves the strongest AWE for fusiform IAs. While the AWE degree is stable for 36 min after contrast injection for saccular IAs.
    CONCLUSIONS: The standardization of imaging protocols and analysis methods for AWE will be helpful for imaging surveillance and further treatment decisions of patients with unruptured IAs.
    CONCLUSIONS: Imaging protocols and measurements of intracranial aneurysm wall enhancement are reported heterogeneously. Aneurysm wall enhancement for fusiform intracranial aneurysms (IAs) is strongest immediately post-contrast, and stable for 36 min for saccular IAs. Future multi-center studies should investigate aneurysm wall enhancement as an emerging marker of aneurysm growth and rupture.
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  • 文章类型: Journal Article
    目的:盆腔器官脱垂量化的金标准是盆腔器官脱垂量化(POP-Q)系统;然而,直立磁共振成像(MRI)是一种很有前途的新方法。这项研究的目的是确定POP-Q与膀胱和子宫颈的MRI测量之间的相关性。
    方法:这项前瞻性研究包括脱垂患者,其中POP-Q点Aa或Ba和C被测量为标准护理。MRI扫描是在直立位置进行的,并计算膀胱和子宫颈最低点到盆腔倾斜矫正系统(PICS)的距离。使用正态分布数据的Pearson相关系数和非正态分布数据的Spearman秩相关系数确定POP-Q和MRI-PICS测量值之间的相关性。
    结果:总共63例患者适合分析。膀胱(r(61)=0.480,r<0.001)和子宫(r(61)=0.527,p<0.001)的POP-Q和MRI-PICS测量值之间存在中度正相关。膀胱和子宫的POP-Q和MRI-PICS之间的测量差异从-3.2cm到7.1cm不等。和从-2.1厘米到8.5厘米分别。在71.4%的患者中,对于膀胱和子宫,在直立MRI上观察到的下降比POP-Q测量更多。对于POP-Q测量相似的患者,发现膀胱和子宫的MRI测量结果存在很大差异.
    结论:尽管存在中度正相关,直立MRI显示71.4%的患者POP范围比POP-Q更大。对于具有相同POP-Q测量值的患者,MRI测量值有很大差异。
    OBJECTIVE: The gold standard for quantifying pelvic organ prolapse is the pelvic organ prolapse quantification (POP-Q) system; however, upright magnetic resonance imaging (MRI) is a promising new method. The objective of this study was to determine the correlation between POP-Q and MRI measurements of the bladder and cervix.
    METHODS: This prospective study included patients with prolapse in whom POP-Q points Aa or Ba and C were measured as standard care. MRI scans were performed in an upright position, and the distances of the lowest points of the bladder and cervix to the Pelvic Inclination Correction System (PICS) were calculated. Correlations between POP-Q and MRI-PICS measurements were determined using the Pearson correlation coefficient for normally distributed data and the Spearman\'s rank correlation coefficient for non-normally distributed data.
    RESULTS: A total of 63 patients were suitable for analysis. There was a moderate positive correlation between the POP-Q and MRI-PICS measurements for bladder (r(61) = 0.480, r < 0.001) and uterus (r(61) = 0.527, p < 0.001). Measurement differences between POP-Q and MRI-PICS of the bladder and uterus vary from -3.2 cm to 7.1 cm, and from -2.1 cm to 8.5 cm respectively. In 71.4% of patients more descent was seen on upright MRI than with POP-Q measurement for both bladder and uterus. For patients with similar POP-Q measurements, a high variation in MRI measurements of the bladder and uterus was found.
    CONCLUSIONS: Despite a moderate positive correlation, upright MRI shows a larger POP extent in 71.4% of the patients than POP-Q. A high variation in MRI measurements for patients with the same POP-Q measurement was seen.
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  • 文章类型: Journal Article
    金属有机骨架(MOF)孔中吸附的客体物种的定量测量对于评估MOF的吸附性能至关重要。然而,常规分析技术,如热重分析不能区分孔中吸附的物质的贡献,吸附在表面上的物种,以及包封在晶间空间中的气相或液相。在这里,我们开发了一种基于交叉极化(CP)固态核磁共振(SSNMR)技术的新定量方法,其中只有MOF孔内的物质被选择性探测,因为迁移率显著降低。以商业化的MOFα-Mg3(HCOO)6为例,Areaguest/Areafrone之间的良好线性相关性(即,客体和框架13C核磁共振信号的综合区域,分别)和客体负载可以观察到几个代表性分子,如苯,四氢呋喃(THF),和1,4-二恶烷,清楚地揭示了CP量化方法的可行性。通过改变客体分子的几何形状和大小,进一步讨论了客体分子和相应的残留迁移率对CP定量的影响。该方法为深入评价多孔材料的吸附性能提供了一条有效且不可替代的途径,特别是液相吸附和气相吸附,其中毛细管冷凝是不可忽略的。
    The quantitative measurement of adsorbed guest species within metal-organic framework (MOF) pores is of fundamental importance for evaluating the adsorption performance of MOFs. However, routine analytic techniques such as thermogravimetric analysis cannot distinguish the contribution from species adsorbed within pores, species adsorbed on the surface, and gas phase or liquid phase encapsulated in the inter-crystalline space. Herein, we developed a new quantification method based on the cross-polarization (CP) solid-state nuclear magnetic resonance (ssNMR) technique, in which only the species within MOF pores are selectively probed due to the dramatically reduced mobility. Using the commercialized MOF α-Mg3(HCOO)6 as an example, a good linear correlation between Areaguest/Areaframework (i. e., the integrated area of guest and framework 13C NMR signals) and guest loading can be observed for several representative molecules such as benzene, tetrahydrofuran (THF), and 1,4-dioxane, clearly revealing the feasibility of CP quantification approach. The effects of guest molecule and corresponding residual mobility on the CP quantification are further discussed by varying the geometry and size of guest molecules. This methodology thus provides an effective and irreplaceable route to evaluate the adsorption performance of porous materials in-depth, especially for liquid-phase adsorption and gas-phase adsorption in which the capillary condensation is not negligible.
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  • 文章类型: Journal Article
    背景:为了支持侧重于早期干预的临床试验设计,我们的研究确定了在痴呆前人群中可靠的早期β淀粉样蛋白(Aβ)积累。
    方法:共有1032名来自淀粉样蛋白成像预防阿尔茨海默病-预后和自然史研究(AMYPAD-PNHS)和Insight46的参与者接受了[18F]氟美他莫,包括[18F]florbetaben或[18F]florbetapir淀粉样蛋白-PET。通过估计子群体中纵向测量值的第95百分位数(NPMNHS=101/750,NInsight46=35/382),使用了规范策略来定义可靠的积累,预计会随着时间的推移保持稳定。使用精确召回分析研究了最佳预测未来积累的基线CL阈值。使用线性混合效应模型检查了累积率。
    结果:PNHS中的可靠积累估计发生在>3.0CL/年。16[12,19]最佳预测未来Aβ累加器的基线CL。淀粉样蛋白积累率与示踪剂无关,对于APOEε4非运营商,以及受教育程度较高的科目。
    结论:我们的结果支持12-20CL窗口纳入早期二级预防研究。可靠的积累定义需要进一步调查。
    To support clinical trial designs focused on early interventions, our study determined reliable early amyloid-β (Aβ) accumulation based on Centiloids (CL) in pre-dementia populations.
    A total of 1032 participants from the Amyloid Imaging to Prevent Alzheimer\'s Disease-Prognostic and Natural History Study (AMYPAD-PNHS) and Insight46 who underwent [18F]flutemetamol, [18F]florbetaben or [18F]florbetapir amyloid-PET were included. A normative strategy was used to define reliable accumulation by estimating the 95th percentile of longitudinal measurements in sub-populations (NPNHS = 101/750, NInsight46 = 35/382) expected to remain stable over time. The baseline CL threshold that optimally predicts future accumulation was investigated using precision-recall analyses. Accumulation rates were examined using linear mixed-effect models.
    Reliable accumulation in the PNHS was estimated to occur at >3.0 CL/year. Baseline CL of 16 [12,19] best predicted future Aβ-accumulators. Rates of amyloid accumulation were tracer-independent, lower for APOE ε4 non-carriers, and for subjects with higher levels of education.
    Our results support a 12-20 CL window for inclusion into early secondary prevention studies. Reliable accumulation definition warrants further investigations.
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  • 文章类型: Journal Article
    与基于培养的方法相比,靶向ipaH的定量聚合酶链反应(qPCR)已被证明在检测临床样品中志贺氏菌方面非常有效,低估志贺氏菌负担2到3倍。qPCR测定法也已开发用于志贺氏菌物种形成和血清分型,这对疫苗开发和评估都至关重要。
    全球卫生(EFGH)志贺氏菌监测研究将利用定制的基于实时PCR的TaqMan阵列卡(TAC)询问82个目标,用于志贺氏菌属的检测和鉴别,宋内志贺氏菌,福氏志贺氏菌血清型,其他腹泻相关的肠病原体,和抗菌素耐药性(AMR)基因。将从直肠拭子或粪便样本中提取总核酸,并在TAC上进行了分析。使用来自先前研究的定量周期截止值,将进行定量分析以确定志贺氏菌和其他特定腹泻病因的可能归因。将qPCR结果与常规培养进行比较,血清分型,和EFGH的表型易感性方法。
    TAC能够同时检测腹泻病因,主要的病原体亚型,和AMR基因。该测定的高灵敏度使得能够更准确地估计志贺氏菌属的疾病负担。这对于告知政策和未来临床试验的设计至关重要。
    UNASSIGNED: Quantitative polymerase chain reaction (qPCR) targeting ipaH has been proven to be highly efficient in detecting Shigella in clinical samples compared to culture-based methods, which underestimate Shigella burden by 2- to 3-fold. qPCR assays have also been developed for Shigella speciation and serotyping, which is critical for both vaccine development and evaluation.
    UNASSIGNED: The Enterics for Global Health (EFGH) Shigella surveillance study will utilize a customized real-time PCR-based TaqMan Array Card (TAC) interrogating 82 targets, for the detection and differentiation of Shigella spp, Shigella sonnei, Shigella flexneri serotypes, other diarrhea-associated enteropathogens, and antimicrobial resistance (AMR) genes. Total nucleic acid will be extracted from rectal swabs or stool samples, and assayed on TAC. Quantitative analysis will be performed to determine the likely attribution of Shigella and other particular etiologies of diarrhea using the quantification cycle cutoffs derived from previous studies. The qPCR results will be compared to conventional culture, serotyping, and phenotypic susceptibility approaches in EFGH.
    UNASSIGNED: TAC enables simultaneous detection of diarrheal etiologies, the principal pathogen subtypes, and AMR genes. The high sensitivity of the assay enables more accurate estimation of Shigella-attributed disease burden, which is critical to informing policy and in the design of future clinical trials.
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  • 文章类型: Journal Article
    在实验室间研究(ILS)中,将用于检测人诺如病毒GI和GIIRNA的优化数字RT-PCR(RT-dPCR)测定法与符合ISO15216的定量实时RT-PCR(RT-qPCR)测定法进行了比较八个实验室。双重GI/GIIRT-dPCR检测,基于ISO15216-寡核苷酸,六个实验室在Bio-RadQX200平台上使用。一个实验室分别使用QiagenQiacity或ThermoFisherQuantStudio3D的适应性测定。ILS包括在不存在基质和牡蛎组织样品中诺如病毒RNA的定量。平均而言,RT-dPCR测定的结果与通过RT-qPCR测定获得的结果非常相似。诺如病毒GI结果的变异系数(CV%)为,然而,在实验室内复制(八次运行)和八个实验室之间,RT-dPCR比RT-qPCR低得多。对于两种检测形式,诺如病毒GII结果的CV%在相同范围内。是否使用了内部制备的dsDNA标准,诺如病毒GII的CV%可能有利于RT-dPCR检测。RT-dPCR和RT-qPCR结果之间的比率因实验室而异,尽管使用分布式RT-qPCRdsDNA标准。研究表明,RT-dPCR分析可能会增加实验室之间定量结果的均匀性。
    An optimized digital RT-PCR (RT-dPCR) assay for the detection of human norovirus GI and GII RNA was compared with ISO 15216-conform quantitative real-time RT-PCR (RT-qPCR) assays in an interlaboratory study (ILS) among eight laboratories. A duplex GI/GII RT-dPCR assay, based on the ISO 15216-oligonucleotides, was used on a Bio-Rad QX200 platform by six laboratories. Adapted assays for Qiagen Qiacuity or ThermoFisher QuantStudio 3D were used by one laboratory each. The ILS comprised quantification of norovirus RNA in the absence of matrix and in oyster tissue samples. On average, results of the RT-dPCR assays were very similar to those obtained by RT-qPCR assays. The coefficient of variation (CV%) of norovirus GI results was, however, much lower for RT-dPCR than for RT-qPCR in intra-laboratory replicates (eight runs) and between the eight laboratories. The CV% of norovirus GII results was in the same range for both detection formats. Had in-house prepared dsDNA standards been used, the CV% of norovirus GII could have been in favor of the RT-dPCR assay. The ratio between RT-dPCR and RT-qPCR results varied per laboratory, despite using the distributed RT-qPCR dsDNA standards. The study indicates that the RT-dPCR assay is likely to increase uniformity of quantitative results between laboratories.
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  • 文章类型: Journal Article
    中药炮制在临床应用中起着重要作用,通常具有“提高效率和减少毒性”的功能。据报道,何首乌(PM)可诱导肝毒性,而据信加工后毒性降低。研究表明,PM的肝毒性与加工前后化学成分的变化密切相关。然而,没有对加工过程中PM的化学变化进行全面的调查。在这项研究中,我们建立了一个全面的方法来分析小分子化合物和多糖从原始和不同的处理PM样品。详细来说,利用在线二维液相色谱与四极-轨道阱质谱联用(2D-LC/Q-OrbitrapMS)来研究小分子,共150个化合物被成功表征。经过多元统计分析,筛选出49种原料和加工产品之间的差异化合物。此外,基于超高效液相色谱/Q-Orbitrap-MS(UHPLC/Q-Orbitrap-MS),在16min内建立了准确,全面的定量PM样品中差异化合物的方法。此外,分析了不同PM样品中多糖的变化,研究发现,黑豆的添加和蒸时间会显著影响PM中多糖的含量和组成。为揭示加工工艺的科学内涵、加强PM的质量控制和安全性提供了参考依据。
    The processing of traditional Chinese medicine (TCM) plays an important role in the clinical application, which usually has the function of \"increasing efficiency and reducing toxicity\". Polygonum multiflorum (PM) has been reported to induce hepatotoxicity, while it is believed that the toxicity is reduced after processing. Studies have shown that the hepatotoxicity of PM is closely related to the changes in chemical components before and after processing. However, there is no comprehensive investigation on the chemical changes of PM during the processing progress. In this research, we established a comprehensive method to profile both small molecule compounds and polysaccharides from raw and different processed PM samples. In detail, an online two-dimensional liquid chromatography coupled with quadrupole-orbitrap mass spectrometry (2D-LC/Q-Orbitrap MS) was utilized to investigate the small molecules, and a total of 150 compounds were characterized successfully. After multivariate statistical analysis, 49 differential compounds between raw and processed products were screened out. Furthermore, an accurate and comprehensive method for quantification of differential compounds in PM samples was established based on ultra-high performance liquid chromatography/Q-Orbitrap-MS (UHPLC/Q-Orbitrap-MS) within 16 min. In addition, the changes of polysaccharides in different PM samples were analyzed, and it was found that the addition of black beans and steaming times would affect the content and composition of polysaccharides in PM significantly. Our work provided a reference basis for revealing the scientific connotation of the processing technology and increasing the quality control and safety of PM.
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