首页 > 最新文献

Journal of analytical and bioanalytical techniques最新文献

英文 中文
Molecular Docking: Approaches, Types, Applications and Basic Challenges 分子对接:方法、类型、应用和基本挑战
Pub Date : 2017-03-27 DOI: 10.4172/2155-9872.1000356
A. M. Dar, Shafia Mir
Abstract Molecular docking is a kind of bioinformatic modelling which involves the interaction of two or more molecules to give the stable adduct. Depending upon binding properties of ligand and target, it predicts the three-dimensional structure of any complex. Molecular docking generates different possible adduct structures that are ranked and grouped together using scoring function in the software. Docking simulations predict optimized docked conformer based upon total energy of the system. In spite of all potential approaches, ligand chemistry (tautomerism and ionization), receptor flexibility (single conformation of rigid receptor) and scoring function (differentiate true binding mode) still remained the challenge. Many important aspects of molecular docking in terms of its approaches, types, applications and challenges are briefly discussed in this article.
分子对接是一种生物信息学建模,涉及两个或多个分子相互作用以获得稳定的加合物。根据配体与靶体的结合特性,它可以预测任何配合物的三维结构。分子对接产生不同可能的加合物结构,使用软件中的评分功能对其进行排序和分组。对接仿真根据系统总能量预测优化的对接构象。尽管有所有可能的方法,配体化学(互变异构和电离),受体灵活性(刚性受体的单一构象)和评分功能(区分真正的结合模式)仍然是一个挑战。本文就分子对接的方法、类型、应用和面临的挑战等方面进行了简要的讨论。
{"title":"Molecular Docking: Approaches, Types, Applications and Basic Challenges","authors":"A. M. Dar, Shafia Mir","doi":"10.4172/2155-9872.1000356","DOIUrl":"https://doi.org/10.4172/2155-9872.1000356","url":null,"abstract":"Abstract \u0000Molecular docking is a kind of bioinformatic modelling which involves the interaction of two or more molecules to give the stable adduct. Depending upon binding properties of ligand and target, it predicts the three-dimensional structure of any complex. Molecular docking generates different possible adduct structures that are ranked and grouped together using scoring function in the software. Docking simulations predict optimized docked conformer based upon total energy of the system. In spite of all potential approaches, ligand chemistry (tautomerism and ionization), receptor flexibility (single conformation of rigid receptor) and scoring function (differentiate true binding mode) still remained the challenge. Many important aspects of molecular docking in terms of its approaches, types, applications and challenges are briefly discussed in this article.","PeriodicalId":14865,"journal":{"name":"Journal of analytical and bioanalytical techniques","volume":null,"pages":null},"PeriodicalIF":0.0,"publicationDate":"2017-03-27","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"88029652","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 119
Rapid Comparison of UVB Absorption Effectiveness of Various Sunscreens byUV-Vis Spectroscopy yuv - vis光谱法快速比较不同防晒霜对UVB的吸收效果
Pub Date : 2017-03-27 DOI: 10.4172/2155-9872.1000355
Ju Chou, T. J. Robinson, Hui Doan
Sunscreens are used to absorb or block harmful sunlight especially ultra violet (UV) radiation. An UV-vis spectrometer was employed to measure absorbance of sunscreen products. The same brand’s sunscreens with sun protection factor (SPF) of 8, 15, 30, and 50 were tested under identical experimental conditions. The results show that the UV absorbance and the transmittance of the sunscreens are associated with the SPF value. The maximum absorbance of the sunscreens measured between 280 to 320 nm (UVB region) is linearly proportional to the SPF value with a correlation coefficient of 0.998 using the same brand’s sunscreens. Thus, the absorbance can be used to evaluate the efficiency of a sunscreen that absorbs or blocks UVB radiation. Several commercial sunscreens of different brands but with the same SPF 30 were compared. The results confirmed that, although different brand sunscreens with the same SPF varied slightly in UV absorbance, they all offer adequate protection against UVB radiation. The utilization of UV-Vis spectroscopy is found to be particularly effective for determination of sunblock efficiency.
防晒霜用于吸收或阻挡有害的阳光,尤其是紫外线辐射。采用紫外-可见分光光度计测定防晒产品的吸光度。同一品牌的防晒系数(SPF)分别为8、15、30和50的防晒霜在相同的实验条件下进行了测试。结果表明,防晒霜的紫外线吸收度和透光率与SPF值有关。同一品牌防晒霜在280 ~ 320 nm (UVB区域)的最大吸光度与SPF值成线性关系,相关系数为0.998。因此,吸光度可以用来评估防晒霜吸收或阻挡UVB辐射的效率。研究人员比较了几种不同品牌但具有相同防晒系数30的商业防晒霜。研究结果证实,尽管不同品牌的防晒霜具有相同的SPF值,但其紫外线吸收能力略有不同,但它们都能提供足够的UVB辐射防护。利用紫外可见光谱法测定防晒霜的功效是特别有效的。
{"title":"Rapid Comparison of UVB Absorption Effectiveness of Various Sunscreens byUV-Vis Spectroscopy","authors":"Ju Chou, T. J. Robinson, Hui Doan","doi":"10.4172/2155-9872.1000355","DOIUrl":"https://doi.org/10.4172/2155-9872.1000355","url":null,"abstract":"Sunscreens are used to absorb or block harmful sunlight especially ultra violet (UV) radiation. An UV-vis spectrometer was employed to measure absorbance of sunscreen products. The same brand’s sunscreens with sun protection factor (SPF) of 8, 15, 30, and 50 were tested under identical experimental conditions. The results show that the UV absorbance and the transmittance of the sunscreens are associated with the SPF value. The maximum absorbance of the sunscreens measured between 280 to 320 nm (UVB region) is linearly proportional to the SPF value with a correlation coefficient of 0.998 using the same brand’s sunscreens. Thus, the absorbance can be used to evaluate the efficiency of a sunscreen that absorbs or blocks UVB radiation. Several commercial sunscreens of different brands but with the same SPF 30 were compared. The results confirmed that, although different brand sunscreens with the same SPF varied slightly in UV absorbance, they all offer adequate protection against UVB radiation. The utilization of UV-Vis spectroscopy is found to be particularly effective for determination of sunblock efficiency.","PeriodicalId":14865,"journal":{"name":"Journal of analytical and bioanalytical techniques","volume":null,"pages":null},"PeriodicalIF":0.0,"publicationDate":"2017-03-27","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"83181230","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 8
Sensitive LC-MS/MS Method for the Simultaneous Determination ofAlogliptin and Voglibose in Human Plasma hplc -MS/MS同时测定人血浆中阿格列汀和伏格列糖的方法
Pub Date : 2017-03-20 DOI: 10.4172/2155-9872.1000354
G. Hemavathi, Hipparagi Sm
Sensitive LC-MS/MS (Liquid Chromatography Tandem Mass Spectrometric) Method for the Simultaneous Determination of Alogliptin and Voglibose in human plasma. A highly sophisticated and sensitive LC-MS/MS method has been developed and validated for the Alogliptin and Voglibose simultaneous determination in human plasma. Alogliptin D3 and Miglitol were used as IS (Internal standard). Protein precipitation extraction was followed for the analytes and IS. Chromatography conditions included an isocratic mobile phase composing of 5 mM Ammonium formate: Acetonitrile in the ratio 50:50 v/v. The column used was Welchrom XB C18, with specifications of 50 × 4.6 mm, 5 μm, at a flow rate of 0.70 ml/min. The retention time of Alogliptin, Voglibose, Alogliptin D3 and Miglitol occurred at ~1.03, 0.8, 0.8 and 0.81 min respectively and the total chromatographic run time was 3.0 min. Alogliptin and Voglibose achieved a linear response function in human plasma at 5.09-509 ng/mL and 2.03-203 ng/mL respectively. Alogliptin and Voglibose achieved an intra and inter-day accuracy and precision in the range of 0.94- 4.35 and 0.91-3.89%; 1.41-10.8 and 1.90-7.75% respectively. The method was strictly validated according to the ICH guidelines. The results obtained from this study can be significantly utilized for developing full pharmacokinetic profiling in individuals.
LC-MS/MS(液相色谱串联质谱)同时测定人血浆中阿格列汀和伏格列糖的方法。建立了一种高精密、高灵敏度的LC-MS/MS同时测定人血浆中阿格列汀和伏格列糖的方法。用阿格列汀D3和米格列醇作为内标。对分析物和IS进行蛋白质沉淀提取。色谱条件为5 mM甲酸铵:乙腈,比例为50:50 v/v。色谱柱为Welchrom XB C18,规格为50 × 4.6 mm, 5 μm,流速为0.70 ml/min。阿格列汀、伏格列糖、阿格列汀D3和米格列醇的保留时间分别为~1.03、0.8、0.8和0.81 min,总色谱运行时间为3.0 min。阿格列汀和伏格列糖在人血浆中分别在5.09 ~ 509 ng/mL和2.03 ~ 203 ng/mL呈线性响应函数。阿格列汀和伏格列波的日内、日间准确度和精密度分别为0.94 ~ 4.35和0.91 ~ 3.89%;分别为1.41-10.8和1.90-7.75%。该方法严格按照ICH指南进行验证。从这项研究中获得的结果可以显著地用于开发完整的个体药代动力学分析。
{"title":"Sensitive LC-MS/MS Method for the Simultaneous Determination ofAlogliptin and Voglibose in Human Plasma","authors":"G. Hemavathi, Hipparagi Sm","doi":"10.4172/2155-9872.1000354","DOIUrl":"https://doi.org/10.4172/2155-9872.1000354","url":null,"abstract":"Sensitive LC-MS/MS (Liquid Chromatography Tandem Mass Spectrometric) Method for the Simultaneous Determination of Alogliptin and Voglibose in human plasma. A highly sophisticated and sensitive LC-MS/MS method has been developed and validated for the Alogliptin and Voglibose simultaneous determination in human plasma. Alogliptin D3 and Miglitol were used as IS (Internal standard). Protein precipitation extraction was followed for the analytes and IS. Chromatography conditions included an isocratic mobile phase composing of 5 mM Ammonium formate: Acetonitrile in the ratio 50:50 v/v. The column used was Welchrom XB C18, with specifications of 50 × 4.6 mm, 5 μm, at a flow rate of 0.70 ml/min. The retention time of Alogliptin, Voglibose, Alogliptin D3 and Miglitol occurred at ~1.03, 0.8, 0.8 and 0.81 min respectively and the total chromatographic run time was 3.0 min. Alogliptin and Voglibose achieved a linear response function in human plasma at 5.09-509 ng/mL and 2.03-203 ng/mL respectively. Alogliptin and Voglibose achieved an intra and inter-day accuracy and precision in the range of 0.94- 4.35 and 0.91-3.89%; 1.41-10.8 and 1.90-7.75% respectively. The method was strictly validated according to the ICH guidelines. The results obtained from this study can be significantly utilized for developing full pharmacokinetic profiling in individuals.","PeriodicalId":14865,"journal":{"name":"Journal of analytical and bioanalytical techniques","volume":null,"pages":null},"PeriodicalIF":0.0,"publicationDate":"2017-03-20","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"79906344","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 1
Sub-Acute Toxicity Studies of Alchornea cordifolia Leaf Extract in SwissAlbino Rats 菖蒲叶提取物对大鼠的亚急性毒性研究
Pub Date : 2017-03-10 DOI: 10.4172/2155-9872.1000353
E. Ee, Ene Ac, Chidi Uzoma Igwe
The ethanolic leaf extract of Alchornea cordifolia (Schum. and Thonn.) Mull. Arg (Euphorbiaceae), a widely used traditional medicinal plant was assessed for possible sub-acute toxicity in Swiss albino rats. The rats were randomly distributed into five groups of four animals each. The groups were respectively administered 125, 250, 500 and 750 mg/kg body weight ethanolic leaf extract of Alchornea cordifolia intra peritoneally daily for (two weeks) 14 days. Normal saline was administered to the control group according to their body weights. The experimental animals were observed for another 14 days before the termination of the experiment. The weight of the animals was recorded daily throughout the duration of the study. The number of deaths in any group was recorded. All the surviving animals were sacrificed after 28 days. Blood samples were collected for biochemical and haematological analysis. Selected organs of the animals i.e., liver and kidney of both the dead and sacrificed animals were removed and stored in 10% formal saline ready for histopathological analysis. Administration of Alchornea cordifolia (0.125- 0.75 g/kg, po daily) for two weeks (14 days) did not affect significantly the relative organ weights, blood chemistry and renal function. Histology of liver and kidney at dose levels up to 0.5 g/kg was normal and similarto vehicletreated controls. However, liver sections of mice treated with 0.75 g/kg Alchornea cordifolia ethanolic leaf extract showed cloudy swelling of hepatocytes with vascular degeneration. These results suggest that Alchornea cordifolia is relatively non-toxic but has the propensity to induce hepatic injury at high doses.
研究了堇叶Alchornea cordifolia (Schum)的乙醇提取物。和Thonn)。考虑。对瑞士白化病大鼠进行了亚急性毒性评价。这些大鼠被随机分为五组,每组4只。各组分别腹腔灌胃125、250、500和750 mg/kg体重的堇叶乙醇提取物,连续2周14 d。对照组按体重给予生理盐水。实验动物继续观察14 d,实验结束。在整个研究期间,每天记录动物的体重。每组的死亡人数都被记录下来。28 d后处死所有存活的动物。采集血样进行生化和血液学分析。选择动物器官,即死亡动物和牺牲动物的肝脏和肾脏,取出并保存在10%正规盐水中,准备进行组织病理学分析。给药(0.125 ~ 0.75 g/kg,每天po次)2周(14天)对相对脏器重量、血液化学和肾功能无显著影响。当剂量水平达到0.5 g/kg时,肝脏和肾脏的组织学正常,与载体处理的对照组相似。然而,0.75 g/kg堇叶乙醇提取物处理小鼠肝脏切片显示肝细胞浑浊肿胀,血管变性。这些结果表明,堇青花是相对无毒的,但在高剂量时有诱导肝损伤的倾向。
{"title":"Sub-Acute Toxicity Studies of Alchornea cordifolia Leaf Extract in SwissAlbino Rats","authors":"E. Ee, Ene Ac, Chidi Uzoma Igwe","doi":"10.4172/2155-9872.1000353","DOIUrl":"https://doi.org/10.4172/2155-9872.1000353","url":null,"abstract":"The ethanolic leaf extract of Alchornea cordifolia (Schum. and Thonn.) Mull. Arg (Euphorbiaceae), a widely used traditional medicinal plant was assessed for possible sub-acute toxicity in Swiss albino rats. The rats were randomly distributed into five groups of four animals each. The groups were respectively administered 125, 250, 500 and 750 mg/kg body weight ethanolic leaf extract of Alchornea cordifolia intra peritoneally daily for (two weeks) 14 days. Normal saline was administered to the control group according to their body weights. The experimental animals were observed for another 14 days before the termination of the experiment. The weight of the animals was recorded daily throughout the duration of the study. The number of deaths in any group was recorded. All the surviving animals were sacrificed after 28 days. Blood samples were collected for biochemical and haematological analysis. Selected organs of the animals i.e., liver and kidney of both the dead and sacrificed animals were removed and stored in 10% formal saline ready for histopathological analysis. Administration of Alchornea cordifolia (0.125- 0.75 g/kg, po daily) for two weeks (14 days) did not affect significantly the relative organ weights, blood chemistry and renal function. Histology of liver and kidney at dose levels up to 0.5 g/kg was normal and similarto vehicletreated controls. However, liver sections of mice treated with 0.75 g/kg Alchornea cordifolia ethanolic leaf extract showed cloudy swelling of hepatocytes with vascular degeneration. These results suggest that Alchornea cordifolia is relatively non-toxic but has the propensity to induce hepatic injury at high doses.","PeriodicalId":14865,"journal":{"name":"Journal of analytical and bioanalytical techniques","volume":null,"pages":null},"PeriodicalIF":0.0,"publicationDate":"2017-03-10","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"75097083","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 2
A Novel Methodology for the Quantification of B-Vitamers in Breast Milk 一种新的定量母乳中维生素b的方法
Pub Date : 2017-03-02 DOI: 10.4172/2155-9872.1000352
K. Redeuil, S. Bénet, M. Affolter, K. SagarThakkar, E. Campos-Giménez
With this report we present development, validation and application of an analytical methodology for the quantification of 18 water soluble vitamers and secreted or biological forms in breast milk. On a relatively low amount of breast milk (200 µL), we applied isotope dilution-based sample preparation based on a combination of enzymatic treatment and protein precipitation using acidic methanol enriched with stable isotope labelled internal standards. Compounds separation was achieved by reversed-phase liquid chromatography and detection performed by tandem mass spectrometry in positive electrospray ionization mode. To perform the quantification of 18 water soluble vitamers, procured pooled breast milk was used to build matrixmatched calibration curves, as labelled internal standards were not available for each vitamer. The analytical approach has been validated according to the EMA guidelines. The overall performance of the method was considered adequate, with 0.3- 28.3% and 0.9-32.6% intra and inter-day precision respectively and averaged accuracy reaching 92.2-107.5%. In addition, performed freeze/thaw stability studies showed the potential degradation of some vitamers. We therefore recommend particular attention in sample collection with rather having dedicated aliquots with small volumes. The feasibility of this analytical approach has been evaluated by quantifying various breast milk samples that were procured from an external supplier. The main forms found in breast milk were thiamine monophosphate for B1, flavin adenine nucleotide for B2, nicotinamide for B3, pyridoxal for B6 and 5-methyl tetrahydrofolic acid for B9. In addition, we newly reported nudifloramide as B3 form present in breast milk. With this analytical approach, it will give more confidence to provide a comprehensive assessment of the presence of water soluble vitamins in breast milk. This will enable the accurate evaluation of the nutritional requirements of infants.
在本报告中,我们提出了一种用于母乳中18种水溶性维生素和分泌或生物形式的定量分析方法的开发、验证和应用。在相对较低的母乳量(200 µL)下,我们采用了同位素稀释的样品制备方法,该方法基于酶处理和蛋白质沉淀的结合,使用富含稳定同位素标记的内标的酸性甲醇。化合物通过反相液相色谱分离,并在正电喷雾电离模式下通过串联质谱进行检测。为了对18种水溶性维生素进行定量,由于每种维生素都没有标记的内标,因此使用收集的母乳建立基质匹配校准曲线。分析方法已根据EMA指南进行验证。该方法的日内和日间精度分别为0.3 ~ 28.3%和0.9 ~ 32.6%,平均精度为92.2 ~ 107.5%,总体性能较好。此外,进行的冻融稳定性研究表明,某些维生素可能会降解。因此,我们建议特别注意样品收集,而不是有专门的等分与小体积。通过对从外部供应商采购的各种母乳样本进行量化,评估了这种分析方法的可行性。母乳中发现的主要形式是B1的单磷酸硫胺素,B2的黄素腺嘌呤核苷酸,B3的烟酰胺,B6的吡哆醛和B9的5-甲基四氢叶酸。此外,我们最近报道了nudifloramide作为B3形式存在于母乳中。有了这种分析方法,对母乳中水溶性维生素的存在进行全面评估将更有信心。这将有助于准确评估婴儿的营养需求。
{"title":"A Novel Methodology for the Quantification of B-Vitamers in Breast Milk","authors":"K. Redeuil, S. Bénet, M. Affolter, K. SagarThakkar, E. Campos-Giménez","doi":"10.4172/2155-9872.1000352","DOIUrl":"https://doi.org/10.4172/2155-9872.1000352","url":null,"abstract":"With this report we present development, validation and application of an analytical methodology for the quantification of 18 water soluble vitamers and secreted or biological forms in breast milk. On a relatively low amount of breast milk (200 µL), we applied isotope dilution-based sample preparation based on a combination of enzymatic treatment and protein precipitation using acidic methanol enriched with stable isotope labelled internal standards. Compounds separation was achieved by reversed-phase liquid chromatography and detection performed by tandem mass spectrometry in positive electrospray ionization mode. To perform the quantification of 18 water soluble vitamers, procured pooled breast milk was used to build matrixmatched calibration curves, as labelled internal standards were not available for each vitamer. The analytical approach has been validated according to the EMA guidelines. The overall performance of the method was considered adequate, with 0.3- 28.3% and 0.9-32.6% intra and inter-day precision respectively and averaged accuracy reaching 92.2-107.5%. In addition, performed freeze/thaw stability studies showed the potential degradation of some vitamers. We therefore recommend particular attention in sample collection with rather having dedicated aliquots with small volumes. The feasibility of this analytical approach has been evaluated by quantifying various breast milk samples that were procured from an external supplier. The main forms found in breast milk were thiamine monophosphate for B1, flavin adenine nucleotide for B2, nicotinamide for B3, pyridoxal for B6 and 5-methyl tetrahydrofolic acid for B9. In addition, we newly reported nudifloramide as B3 form present in breast milk. With this analytical approach, it will give more confidence to provide a comprehensive assessment of the presence of water soluble vitamins in breast milk. This will enable the accurate evaluation of the nutritional requirements of infants.","PeriodicalId":14865,"journal":{"name":"Journal of analytical and bioanalytical techniques","volume":null,"pages":null},"PeriodicalIF":0.0,"publicationDate":"2017-03-02","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"80222220","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 8
Synthesis of Surface Molecularly Imprinting Polymers for Methylphenidate andits Application in Separating Methylphenidate 哌甲酯表面分子印迹聚合物的合成及其在哌甲酯分离中的应用
Pub Date : 2017-02-28 DOI: 10.4172/2155-9872.1000351
M. Khansari, Sara Shahreza, A. Rezvanirad, Amin Nikavar, Shahrzad Bikloo, B. Yousefsani
In this study, a novel approach is proposed for determination of methylphenidate in biological fluids. In this method molecularly imprinted solid-phase extraction (MISPE), as the sample extraction technique, combined with high-performance liquid chromatography (HPLC) is used. The water-compatible molecularly imprinted polymers (MIPs) were prepared using methacrylic acid as functional monomer, ethylene glycol dimethacrylate as cross-linker, Hexane as porogen and methylphenidate as template molecule. Extraction of methylphenidate from human serum was carried out using a novel imprinted polymer as the solid-phase extraction (SPE). Various parameters affecting the extraction efficiency of the polymer were evaluated. Also, the optimal conditions for the MIP cartridges were studied. The limit of detection (LOD) and limit of quantification (LOQ) for methylphenidate in serum samples were 1.3 and 10 ng mL-1, respectively. The recoveries for serum samples were higher than 92%.
本研究提出了一种测定生物体液中哌甲酯含量的新方法。该方法采用分子印迹固相萃取(MISPE)作为样品提取技术,结合高效液相色谱(HPLC)。以甲基丙烯酸为功能单体,乙二醇二甲基丙烯酸酯为交联剂,己烷为多孔剂,哌醋甲酯为模板分子,制备了水相容性分子印迹聚合物(MIPs)。采用新型印迹聚合物固相萃取(SPE)技术从人血清中提取哌甲酯。考察了影响聚合物萃取效率的各种参数。同时,研究了MIP筒的最佳工艺条件。血清样品中哌甲酯的检出限(LOD)和定量限(LOQ)分别为1.3和10 ng mL-1。血清样品加样回收率大于92%。
{"title":"Synthesis of Surface Molecularly Imprinting Polymers for Methylphenidate andits Application in Separating Methylphenidate","authors":"M. Khansari, Sara Shahreza, A. Rezvanirad, Amin Nikavar, Shahrzad Bikloo, B. Yousefsani","doi":"10.4172/2155-9872.1000351","DOIUrl":"https://doi.org/10.4172/2155-9872.1000351","url":null,"abstract":"In this study, a novel approach is proposed for determination of methylphenidate in biological fluids. In this method molecularly imprinted solid-phase extraction (MISPE), as the sample extraction technique, combined with high-performance liquid chromatography (HPLC) is used. The water-compatible molecularly imprinted polymers (MIPs) were prepared using methacrylic acid as functional monomer, ethylene glycol dimethacrylate as cross-linker, Hexane as porogen and methylphenidate as template molecule. Extraction of methylphenidate from human serum was carried out using a novel imprinted polymer as the solid-phase extraction (SPE). Various parameters affecting the extraction efficiency of the polymer were evaluated. Also, the optimal conditions for the MIP cartridges were studied. The limit of detection (LOD) and limit of quantification (LOQ) for methylphenidate in serum samples were 1.3 and 10 ng mL-1, respectively. The recoveries for serum samples were higher than 92%.","PeriodicalId":14865,"journal":{"name":"Journal of analytical and bioanalytical techniques","volume":null,"pages":null},"PeriodicalIF":0.0,"publicationDate":"2017-02-28","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"73827579","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 1
Determination of Epinephrine at a Screen-Printed Composite Electrode Based onGraphite and Polyurethane 石墨-聚氨酯丝网印刷复合电极上测定肾上腺素
Pub Date : 2017-02-27 DOI: 10.4172/2155-9872.1000350
Dias Iarb, Saciloto Tr, P. Cervini, Cavalheiro Etg
A screen-printed electrode based on a graphite and polyurethane composite (SPGPU) was used in the determination of epinephrine (EP) in cerebral synthetic fluid (CSF) sample. Both Differential Pulse Voltammetry (DPV) and Square Wave Voltammetry (SWV) were used to investigate the suitability of sensor for determination of EP. Under the optimum conditions, the analyte oxidation signal was observed at 0.17 and 0.080 V for DPV and SWV, respectively (vs. pseudo-Ag¦AgCl) in phosphate buffer (pH=7.4). A linear region between 0.10 and 1.0 µmol L-1 was observed in DPV, with detection limit of 6.2 × 10-7 mol L-1 (R=0.997). In SWV two linear ranges were observed, the first one between 0.10 and 0.80 µmol L-1 and the second from 1.0 to 8.0 µmol L-1 with limit of detection 9.5 × 10-8 and 6.0 × 10-7 mol L-1 (R=0.998) respectively. Recoveries of 99 to 100% were observed using the sensor for determination of epinephrine in the CSF. Interference tests showed that uric and ascorbic acids as well as dopamine increase the current of epinephrine, with acceptable levels for UA. The use of a standard addition of EP in the CSF solution containing the ascorbic acid allowed minimizing such interference.
采用石墨-聚氨酯复合材料(SPGPU)丝网印刷电极测定脑合成液(CSF)样品中的肾上腺素(EP)。采用差分脉冲伏安法(DPV)和方波伏安法(SWV)考察传感器测定EP的适用性。在最佳条件下,在pH=7.4的磷酸盐缓冲液中,DPV和SWV分别为0.17 V和0.080 V(相对于伪ag μ AgCl)时,可观察到分析物的氧化信号。DPV在0.10 ~ 1.0µmol L-1之间呈线性关系,检出限为6.2 × 10-7 mol L-1 (R=0.997)。在SWV范围内,0.1 ~ 0.80µmol L-1和1.0 ~ 8.0µmol L-1呈线性关系,检出限分别为9.5 × 10-8和6.0 × 10-7 mol L-1 (R=0.998)。使用传感器测定脑脊液中肾上腺素的回收率为99 ~ 100%。干扰试验表明,尿酸和抗坏血酸以及多巴胺增加了肾上腺素的电流,在UA可接受的水平。在含有抗坏血酸的脑脊液溶液中加入标准的EP可以最大限度地减少这种干扰。
{"title":"Determination of Epinephrine at a Screen-Printed Composite Electrode Based onGraphite and Polyurethane","authors":"Dias Iarb, Saciloto Tr, P. Cervini, Cavalheiro Etg","doi":"10.4172/2155-9872.1000350","DOIUrl":"https://doi.org/10.4172/2155-9872.1000350","url":null,"abstract":"A screen-printed electrode based on a graphite and polyurethane composite (SPGPU) was used in the determination of epinephrine (EP) in cerebral synthetic fluid (CSF) sample. Both Differential Pulse Voltammetry (DPV) and Square Wave Voltammetry (SWV) were used to investigate the suitability of sensor for determination of EP. Under the optimum conditions, the analyte oxidation signal was observed at 0.17 and 0.080 V for DPV and SWV, respectively (vs. pseudo-Ag¦AgCl) in phosphate buffer (pH=7.4). A linear region between 0.10 and 1.0 µmol L-1 was observed in DPV, with detection limit of 6.2 × 10-7 mol L-1 (R=0.997). In SWV two linear ranges were observed, the first one between 0.10 and 0.80 µmol L-1 and the second from 1.0 to 8.0 µmol L-1 with limit of detection 9.5 × 10-8 and 6.0 × 10-7 mol L-1 (R=0.998) respectively. Recoveries of 99 to 100% were observed using the sensor for determination of epinephrine in the CSF. Interference tests showed that uric and ascorbic acids as well as dopamine increase the current of epinephrine, with acceptable levels for UA. The use of a standard addition of EP in the CSF solution containing the ascorbic acid allowed minimizing such interference.","PeriodicalId":14865,"journal":{"name":"Journal of analytical and bioanalytical techniques","volume":null,"pages":null},"PeriodicalIF":0.0,"publicationDate":"2017-02-27","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"79435366","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 6
Photocatalytic studies of tio2/sio2 nanocomposite xerogels 二氧化钛/二氧化硅纳米复合干凝胶的光催化研究
Pub Date : 2017-02-25 DOI: 10.4172/2155-9872.1000348
Muhammad Yaseen, Z. Shah, R. C. Veses, S. Dias, E. Lima, G. S. Reis, J. C. Vaghetti, W. S. Alencar, K. Mehmood
The use of titania-silica materials in photocatalytic processes has been proposed as an alternative to the conventional TiO2 catalysts, in order to facilitate the separation of products after the reaction. However, despite the large number of research in this field, the mechanism governing the photocatalytic activity of the mixed TiO2/SiO2 oxides is not clear. Titania-Silica nanocomposite xerogels were prepared by sol-gel method. This work has been used to describe the synthesis and the photocatalytic properties of TiO2-SiO2 nanocomposite xerogel. The nanocomposite xerogels were prepared by keeping the molar ratio of TEOS:TTIP:MtOH:DIW at 1: 1:6:14 respectively and the catalysts used were HCl and NH4OH. After the preparation xerogels were characterized by FTIR, XRD, UV and LLS. All these techniques show the amorphous nature of Titania-silica xerogel.
为了促进反应后产物的分离,人们提出在光催化过程中使用二氧化钛-二氧化硅材料作为传统TiO2催化剂的替代品。然而,尽管在该领域进行了大量的研究,但TiO2/SiO2混合氧化物光催化活性的机理尚不清楚。采用溶胶-凝胶法制备了二氧化钛-二氧化硅纳米复合干凝胶。本文研究了二氧化钛-二氧化硅纳米复合静电凝胶的合成及其光催化性能。以HCl和NH4OH为催化剂,将TEOS:TTIP:MtOH:DIW的摩尔比分别保持在1:1:6 . 14,制备了纳米复合干凝胶。制备后用FTIR、XRD、UV和LLS对其进行了表征。所有这些技术都显示了二氧化钛干凝胶的无定形性质。
{"title":"Photocatalytic studies of tio2/sio2 nanocomposite xerogels","authors":"Muhammad Yaseen, Z. Shah, R. C. Veses, S. Dias, E. Lima, G. S. Reis, J. C. Vaghetti, W. S. Alencar, K. Mehmood","doi":"10.4172/2155-9872.1000348","DOIUrl":"https://doi.org/10.4172/2155-9872.1000348","url":null,"abstract":"The use of titania-silica materials in photocatalytic processes has been proposed as an alternative to the conventional TiO2 catalysts, in order to facilitate the separation of products after the reaction. However, despite the large number of research in this field, the mechanism governing the photocatalytic activity of the mixed TiO2/SiO2 oxides is not clear. Titania-Silica nanocomposite xerogels were prepared by sol-gel method. This work has been used to describe the synthesis and the photocatalytic properties of TiO2-SiO2 nanocomposite xerogel. The nanocomposite xerogels were prepared by keeping the molar ratio of TEOS:TTIP:MtOH:DIW at 1: 1:6:14 respectively and the catalysts used were HCl and NH4OH. After the preparation xerogels were characterized by FTIR, XRD, UV and LLS. All these techniques show the amorphous nature of Titania-silica xerogel.","PeriodicalId":14865,"journal":{"name":"Journal of analytical and bioanalytical techniques","volume":null,"pages":null},"PeriodicalIF":0.0,"publicationDate":"2017-02-25","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"89949847","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 20
Classification of Cannabis Cultivars Marketed in Canada for Medical Purposes byQuantification of Cannabinoids and Terpenes Using HPLC-DAD and GC-MS 用HPLC-DAD和GC-MS定量分析大麻素和萜烯对加拿大医用大麻品种的分类
Pub Date : 2017-02-20 DOI: 10.4172/2155-9872.1000349
Dan Jin, Shengxi Jin, Yang Yu, Colin Lee, Jie Chen
For over a century, research on cannabis has been hampered by its legal status as a narcotic. The recent legalization of cannabis for medical purposes in North America requires rigorous standardization of its phytochemical composition in the interest of consumer safety and medicinal efficacy. To utilize medicinal cannabis as a predictable medicine, it is crucial to classify hundreds of cultivars with respect to dozens of therapeutic cannabinoids and terpenes, as opposed to the current industrial or forensic classifications that only consider the primary cannabinoids tetrahydrocannabinol (THC) and cannabidiol (CBD). We have recently developed and validated analytical methods using high-pressure liquid chromatography (HPLC-DAD) to quantify cannabinoids and gas chromatography with mass spectroscopy (GC-MS) to quantify terpenes in cannabis raw material currently marketed in Canada. We classified 32 cannabis samples from two licensed producers into four clusters based on the content of 10 cannabinoids and 14 terpenes. The classification results were confirmed by cluster analysis and principal component analysis in tandem, which were distinct from those using only THC and CBD. Cannabis classification using a full spectrum of compounds will more closely meet the practical needs of cannabis applications in clinical research, insdustrial production, and patients’ self-production in Canada. As such, this holistic classification methodology will contribute to the standardization of commercially-available cannabis cultivars in support of a continuously growing market.
一个多世纪以来,大麻的研究一直受到其作为麻醉剂的法律地位的阻碍。北美最近将医用大麻合法化,要求对其植物化学成分进行严格的标准化,以保障消费者安全和医疗功效。为了利用医用大麻作为一种可预测的药物,至关重要的是要对数百个品种进行分类,涉及数十种治疗性大麻素和萜烯,而不是目前的工业或法医分类,仅考虑初级大麻素四氢大麻酚(THC)和大麻二酚(CBD)。我们最近开发并验证了使用高压液相色谱(HPLC-DAD)定量大麻素和气相色谱质谱(GC-MS)定量大麻原料中萜烯的分析方法,目前在加拿大上市。我们根据10种大麻素和14种萜烯的含量将来自两家许可生产商的32种大麻样本分为四类。采用聚类分析和主成分分析相结合的方法验证了四氢大麻酚和CBD的分类结果。使用全谱化合物对大麻进行分类将更符合加拿大大麻在临床研究、工业生产和患者自我生产中的实际应用需求。因此,这种整体分类方法将有助于商业化大麻品种的标准化,以支持不断增长的市场。
{"title":"Classification of Cannabis Cultivars Marketed in Canada for Medical Purposes byQuantification of Cannabinoids and Terpenes Using HPLC-DAD and GC-MS","authors":"Dan Jin, Shengxi Jin, Yang Yu, Colin Lee, Jie Chen","doi":"10.4172/2155-9872.1000349","DOIUrl":"https://doi.org/10.4172/2155-9872.1000349","url":null,"abstract":"For over a century, research on cannabis has been hampered by its legal status as a narcotic. The recent legalization of cannabis for medical purposes in North America requires rigorous standardization of its phytochemical composition in the interest of consumer safety and medicinal efficacy. To utilize medicinal cannabis as a predictable medicine, it is crucial to classify hundreds of cultivars with respect to dozens of therapeutic cannabinoids and terpenes, as opposed to the current industrial or forensic classifications that only consider the primary cannabinoids tetrahydrocannabinol (THC) and cannabidiol (CBD). We have recently developed and validated analytical methods using high-pressure liquid chromatography (HPLC-DAD) to quantify cannabinoids and gas chromatography with mass spectroscopy (GC-MS) to quantify terpenes in cannabis raw material currently marketed in Canada. We classified 32 cannabis samples from two licensed producers into four clusters based on the content of 10 cannabinoids and 14 terpenes. The classification results were confirmed by cluster analysis and principal component analysis in tandem, which were distinct from those using only THC and CBD. Cannabis classification using a full spectrum of compounds will more closely meet the practical needs of cannabis applications in clinical research, insdustrial production, and patients’ self-production in Canada. As such, this holistic classification methodology will contribute to the standardization of commercially-available cannabis cultivars in support of a continuously growing market.","PeriodicalId":14865,"journal":{"name":"Journal of analytical and bioanalytical techniques","volume":null,"pages":null},"PeriodicalIF":0.0,"publicationDate":"2017-02-20","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"78339487","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 35
Effect of Physicochemical Parameters on Screening Characteristics of Suspension in Bioremediation Sampling 理化参数对生物修复样品中悬浮液筛选特性的影响
Pub Date : 2017-01-31 DOI: 10.4172/2155-9872.1000345
Ukpaka Cp, Umah Kingdom
The research demonstrates the significance of some physicochemical parameters on the screening characteristics of suspension in bioremediation sampling. In this investigation, physicochemical parameters of soil sample polluted with crude oil was subjected into sampling by considering the total phosphorus, nitrogen and pH concentration at initial, intermediate and final stage upon the influence of the period of exposure as well as the average values were determined mathematically. The mathematical tools of matrix was formulated from the obtained data and resolved using the mathematical techniques known as matlab (Matrix Laboratory) computer programme language. The results obtained revealed the influence of physicochemical parameters as well as the microbial concentration on increasing the screening characteristics of suspension in bioremediation during sampling.
研究表明,在生物修复取样中,一些理化参数对悬浮液的筛选特性具有重要意义。在本次调查中,考虑了原油污染土壤样品在初始、中期和最终阶段的总磷、总氮和总pH浓度对暴露时间的影响,对土壤样品的理化参数进行了采样,并通过数学方法确定了其平均值。矩阵的数学工具是根据所获得的数据制定的,并使用称为matlab(矩阵实验室)计算机程序语言的数学技术进行求解。结果揭示了采样过程中理化参数和微生物浓度对提高悬浮液生物修复筛选特性的影响。
{"title":"Effect of Physicochemical Parameters on Screening Characteristics of Suspension in Bioremediation Sampling","authors":"Ukpaka Cp, Umah Kingdom","doi":"10.4172/2155-9872.1000345","DOIUrl":"https://doi.org/10.4172/2155-9872.1000345","url":null,"abstract":"The research demonstrates the significance of some physicochemical parameters on the screening characteristics of suspension in bioremediation sampling. In this investigation, physicochemical parameters of soil sample polluted with crude oil was subjected into sampling by considering the total phosphorus, nitrogen and pH concentration at initial, intermediate and final stage upon the influence of the period of exposure as well as the average values were determined mathematically. The mathematical tools of matrix was formulated from the obtained data and resolved using the mathematical techniques known as matlab (Matrix Laboratory) computer programme language. The results obtained revealed the influence of physicochemical parameters as well as the microbial concentration on increasing the screening characteristics of suspension in bioremediation during sampling.","PeriodicalId":14865,"journal":{"name":"Journal of analytical and bioanalytical techniques","volume":null,"pages":null},"PeriodicalIF":0.0,"publicationDate":"2017-01-31","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"77700402","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 1
期刊
Journal of analytical and bioanalytical techniques
全部 Acc. Chem. Res. ACS Applied Bio Materials ACS Appl. Electron. Mater. ACS Appl. Energy Mater. ACS Appl. Mater. Interfaces ACS Appl. Nano Mater. ACS Appl. Polym. Mater. ACS BIOMATER-SCI ENG ACS Catal. ACS Cent. Sci. ACS Chem. Biol. ACS Chemical Health & Safety ACS Chem. Neurosci. ACS Comb. Sci. ACS Earth Space Chem. ACS Energy Lett. ACS Infect. Dis. ACS Macro Lett. ACS Mater. Lett. ACS Med. Chem. Lett. ACS Nano ACS Omega ACS Photonics ACS Sens. ACS Sustainable Chem. Eng. ACS Synth. Biol. Anal. Chem. BIOCHEMISTRY-US Bioconjugate Chem. BIOMACROMOLECULES Chem. Res. Toxicol. Chem. Rev. Chem. Mater. CRYST GROWTH DES ENERG FUEL Environ. Sci. Technol. Environ. Sci. Technol. Lett. Eur. J. Inorg. Chem. IND ENG CHEM RES Inorg. Chem. J. Agric. Food. Chem. J. Chem. Eng. Data J. Chem. Educ. J. Chem. Inf. Model. J. Chem. Theory Comput. J. Med. Chem. J. Nat. Prod. J PROTEOME RES J. Am. Chem. Soc. LANGMUIR MACROMOLECULES Mol. Pharmaceutics Nano Lett. Org. Lett. ORG PROCESS RES DEV ORGANOMETALLICS J. Org. Chem. J. Phys. Chem. J. Phys. Chem. A J. Phys. Chem. B J. Phys. Chem. C J. Phys. Chem. Lett. Analyst Anal. Methods Biomater. Sci. Catal. Sci. Technol. Chem. Commun. Chem. Soc. Rev. CHEM EDUC RES PRACT CRYSTENGCOMM Dalton Trans. Energy Environ. Sci. ENVIRON SCI-NANO ENVIRON SCI-PROC IMP ENVIRON SCI-WAT RES Faraday Discuss. Food Funct. Green Chem. Inorg. Chem. Front. Integr. Biol. J. Anal. At. Spectrom. J. Mater. Chem. A J. Mater. Chem. B J. Mater. Chem. C Lab Chip Mater. Chem. Front. Mater. Horiz. MEDCHEMCOMM Metallomics Mol. Biosyst. Mol. Syst. Des. Eng. Nanoscale Nanoscale Horiz. Nat. Prod. Rep. New J. Chem. Org. Biomol. Chem. Org. Chem. Front. PHOTOCH PHOTOBIO SCI PCCP Polym. Chem.
×
引用
GB/T 7714-2015
复制
MLA
复制
APA
复制
导出至
BibTeX EndNote RefMan NoteFirst NoteExpress
×
0
微信
客服QQ
Book学术公众号 扫码关注我们
反馈
×
意见反馈
请填写您的意见或建议
请填写您的手机或邮箱
×
提示
您的信息不完整,为了账户安全,请先补充。
现在去补充
×
提示
您因"违规操作"
具体请查看互助需知
我知道了
×
提示
现在去查看 取消
×
提示
确定
Book学术官方微信
Book学术文献互助
Book学术文献互助群
群 号:481959085
Book学术
文献互助 智能选刊 最新文献 互助须知 联系我们:info@booksci.cn
Book学术提供免费学术资源搜索服务,方便国内外学者检索中英文文献。致力于提供最便捷和优质的服务体验。
Copyright © 2023 Book学术 All rights reserved.
ghs 京公网安备 11010802042870号 京ICP备2023020795号-1