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81.
82.
C. D. Wick M. G. Martin J. I. Siepmann M. R. Schure 《International Journal of Thermophysics》2001,22(1):111-122
Accurate predictions of retention times, retention indices, and partition constants are a long sought-after goal for theoretical studies in chromatography. Although advances in computational chemistry have improved our understanding of molecular interactions, little attention has been focused on chromatography, let alone calculations of retention properties. Configurational-bias Monte Carlo simulations in the isobaric–isothermal Gibbs ensemble were used to investigate the partitioning of benzene, toluene, and the three xylene isomers between a squalane liquid phase and a helium vapor phase. The united-atom representation of the TraPPE (transferable potentials for phase equilibria) force field was used for all solutes and squalane. The Gibbs free energies of transfer and Kovats retention indices of the solutes were calculated directly from the partition constants (which were averaged over several independent simulations). While the calculated Kovats indices of benzene and toluene at T=403 K are significantly higher than their experimental counterparts, much better agreement is found for the xylene isomers at T=365 K. 相似文献
83.
目的 对液相氧化脱硫多室内环流反应器液体循环量的影响因素进行模拟和验证。方法 采用CFD数值模拟,基于欧拉-欧拉多相流模型,对液相氧化脱硫多室内环流反应器进行气液两相流模拟,考查了酸气流量和空气流量对液体循环量的影响。结果 利用数值模拟得到的液体循环量与利用靶式流量计测得的液体循环量误差小于10%。当酸气中H2S体积分数不超过3%时,液体循环量(z)与酸气流量(x)、空气流量(y)之间的关系式为:z=-474.996+0.358x+0.487 3y。结论 欧拉-欧拉两相流模型能够准确地预测液相氧化脱硫反应器内液体循环量。 相似文献
84.
基于在紫外光照下可变形的液晶高弹体与铁电驻极体材料,设计了一种光电转换器模型器件。该模型器件能实现在紫外光照射下的电信号输出功能。建立了光电耦合分析模型,并分析了紫外光光强对产生感应电荷的影响。结果表明,该模型器件可指导开发一种能够测量一定光强范围内紫外光强度的光电传感器。 相似文献
85.
目的 确定淡竹叶多酚提取纯化工艺,分析主要成分及体外抗氧化活性。方法 采用超声辅助提取淡竹叶多酚,通过响应面实验确定最佳提取条件。选取适合淡竹叶多酚纯化的大孔树脂,对纯化工艺参数进行优化。通过高效液相色谱-质谱法(high performance liquid chromatography-mass spectrometry, HPLC-MS)鉴定淡竹叶多酚的主要成分,并评价其体外抗氧化活性。结果 淡竹叶多酚的最佳提取工艺参数为:乙醇体积分数60%、超声功率500 W、料液比1:25 (g/mL)、超声时间24 min及超声温度59℃,该条件下淡竹叶多酚提取量为8.01 mg/g。淡竹叶多酚纯化工艺参数为:上样质量浓度6 mg/mL、pH 4、流速2 mL/min、解吸液为70%乙醇、解吸体积90 mL,纯化后的淡竹叶多酚纯度由12.86%提高到76.18%。通过HPLC-MS鉴定出16种酚类成分,且纯化后多酚有较高的抗氧化活性。结论 本研究得到了淡竹叶多酚提取纯化工艺,得到的多酚纯化物有明显的抗氧化活性。 相似文献
86.
Haneul Lee Su Jin Kang Jimin Lee Kyong Hwa Park Won Jong Rhee 《International journal of molecular sciences》2022,23(13)
Prostate cancer (PCa) is the most commonly diagnosed malignancy among men in developed countries. The five-year survival rate for men diagnosed with early-stage PCa is approximately 100%, while it is less than 30% for castration-resistant PCa (CRPC). Currently, the detection of prostate-specific antigens as biomarkers for the prognosis of CRPC is criticized because of its low accuracy, high invasiveness, and high false-positive rate. Therefore, it is important to identify new biomarkers for prediction of CRPC progression. Extracellular vesicles (EVs) derived from tumors have been highlighted as potential markers for cancer diagnosis and prognosis. Specifically, urinary EVs directly reflect changes in the pathophysiological conditions of the urogenital system because it is exposed to prostatic secretions. Thus, detecting biomarkers in urinary EVs provides a promising approach for performing an accurate and non-invasive liquid biopsy for CPRC. In this study, we effectively isolated urinary EVs with low protein impurities using size-exclusion chromatography combined with ultrafiltration. After EV isolation and characterization, we evaluated the miRNAs in urinary EVs from healthy donors and patients with CRPC. The results indicated that miRNAs (miR-21-5p, miR-574-3p, and miR-6880-5p) could be used as potential biomarkers for the prognosis of CRPC. This analysis of urinary EVs contributes to the fast and convenient prognosis of diseases, including CRPC, in the clinical setting. 相似文献
87.
针对煤衍生重质产品的组分分析,以高效液相色谱(HPLC)研究了其定量问题。首先,建立高分辨的色谱分离体系,使组分得以好的分离和定性。对各分离组分定量测定采用了外标法和外标-定量因子法。实验表明准确定量的技术关键在于:溶解样品溶剂的合理选择;配制样品溶液浓度的正确控制;配制样品溶液的进一步处理技术。 相似文献
88.
Carlos Casas-Arozamena Alexandra Cortegoso Raquel Pieiro-Perez Alicia Abalo Efigenia Arias Victoria Sampayo Ana Vilar Marta Bouso Eva Diaz Gema Moreno-Bueno Rafael Lpez-Lpez Laura Muinelo-Romay Miguel Abal Juan Cueva 《International journal of molecular sciences》2022,23(15)
Endometrial cancer (EC) is the 4th most common neoplasm of the female genital tract, with 15–20% of patients being of high risk of recurrence which leads to a significant decrease in patient survival. Current therapeutic options for patients with EC are poor, being the combined therapy of carboplatin and paclitaxel the standard of care, with limited efficacy. Therefore, new therapeutic options and better monitoring tools are needed to improve the management of the disease. In the current case report, we showcase the value of liquid biopsy analyses in a microsatellite instability EC patient with initially good prognosis that however underwent rapid progression disease within 6 months post-surgery; through the study of plasma cfDNA/ctDNA dynamics to assess the tumour evolution during treatment, as well as the study of the uterine aspirate as a valuable sample that captures the intra-tumour heterogeneity that allows a comprehensive genomic profiling of the disease to identify potential therapeutic options. Furthermore, preclinical models were generated at the time of tumour progression to assess the efficacy of the identified targeted therapies. 相似文献
89.
Tanzila Khan Therese M. Becker Joseph W. Po Wei Chua Yafeng Ma 《International journal of molecular sciences》2022,23(15)
The field of single-cell analysis has advanced rapidly in the last decade and is providing new insights into the characterization of intercellular genetic heterogeneity and complexity, especially in human cancer. In this regard, analyzing single circulating tumor cells (CTCs) is becoming particularly attractive due to the easy access to CTCs from simple blood samples called “liquid biopsies”. Analysis of multiple single CTCs has the potential to allow the identification and characterization of cancer heterogeneity to guide best therapy and predict therapeutic response. However, single-CTC analysis is restricted by the low amounts of DNA in a single cell genome. Whole genome amplification (WGA) techniques have emerged as a key step, enabling single-cell downstream molecular analysis. Here, we provide an overview of recent advances in WGA and their applications in the genetic analysis of single CTCs, along with prospective views towards clinical applications. First, we focus on the technical challenges of isolating and recovering single CTCs and then explore different WGA methodologies and recent developments which have been utilized to amplify single cell genomes for further downstream analysis. Lastly, we list a portfolio of CTC studies which employ WGA and single-cell analysis for genetic heterogeneity and biomarker detection. 相似文献
90.
简单介绍了射频电容液位计进行油水双液位检测的基本原理,阐述了海上溢油回收检测装置的基本构造及其工作过程。针对海上特殊应用环境的测量需求,提出分别按油、按水标定的液位检测方案。油水混合状态下,对2组实验测试数据进行误差和线性度的数值计算,通过曲线拟合对比分析,最终确定了海上溢油回收集油箱油位检测的最优化方案—按油标定检测。实验证明,该方案可以满足现场实际测量环境的要求,液位计的测量精度高、线性度好。 相似文献