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FDTD算法的线性预测吸收边界条件
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作者 张继龙 甄蜀春 +2 位作者 曹鹏 王毅增 刘刚 《微波学报》 CSCD 北大核心 2003年第3期22-24,共3页
提出了一种全新的FDTD吸收边界条件———线性预测吸收边界条件 (LinearPredictionAbsorbingBoundaryCondition———LPABC)。通过对吸收边界上的入射场进行深入的分析研究 ,发现在某些条件下吸收边界上的场值与入射方向上其相邻区域的... 提出了一种全新的FDTD吸收边界条件———线性预测吸收边界条件 (LinearPredictionAbsorbingBoundaryCondition———LPABC)。通过对吸收边界上的入射场进行深入的分析研究 ,发现在某些条件下吸收边界上的场值与入射方向上其相邻区域的场值是线性相关的 ,从而提出了一种利用入射方向相邻区域的场值对吸收边界上的场值进行线性预测的吸收边界条件。采用这种吸收边界条件 ,计算域内的场为行波场 ,在边界处是无反射的。此外 ,这种吸收边界条件不需要设置额外的吸收层 ,也不需要存储前一时刻的场值。最后进行了FDTD实际计算 。 展开更多
关键词 FDTD 时域有限差分法 吸收边界 线性预测吸收边界条件 LPABC 入射场 入射方向 电磁场
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药物经皮吸收数学模型研究进展 被引量:17
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作者 何星垚 王晖 《中国药理学通报》 CAS CSCD 北大核心 2015年第5期596-600,共5页
经皮给药是一种能避免肝脏的首过效应及肠胃灭活、维持血药浓度、提高生物利用度的给药途径。而药物经皮吸收需透过角质层、活性表皮层、真皮层的屏障。近年来,随着计算机技术的发展,根据药物的不同理化特性及皮肤各层的生理特征,建立... 经皮给药是一种能避免肝脏的首过效应及肠胃灭活、维持血药浓度、提高生物利用度的给药途径。而药物经皮吸收需透过角质层、活性表皮层、真皮层的屏障。近年来,随着计算机技术的发展,根据药物的不同理化特性及皮肤各层的生理特征,建立了许多预测药物经皮吸收方面的数学模型。该文就预测药物经皮吸收数学模型的研究进展进行了综述。 展开更多
关键词 经皮吸收 透皮吸收 预测药物经皮吸收 数学模型 透皮系数 经皮给药 经皮转运
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新形势下药剂学在临床中的应用 被引量:6
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作者 林美玉 《中国医药指南》 2013年第5期377-378,共2页
生物药剂学在现今的临床医学中占据着越来越重要的地位,新药开发及药物质量研究都离不开药剂学工作,为保证医院临床的新药剂给药途径,就需对新药物在人体内吸收等详细过程进行分析检测,目前,医院渐渐将"以医生为中心"的医学... 生物药剂学在现今的临床医学中占据着越来越重要的地位,新药开发及药物质量研究都离不开药剂学工作,为保证医院临床的新药剂给药途径,就需对新药物在人体内吸收等详细过程进行分析检测,目前,医院渐渐将"以医生为中心"的医学模式转变为"以患者为中心",这也要求医师对各项药物的合理用量都有着准确把握,从以上两方面可以看出,药剂学在临床中的合理应用使保证临床就诊质量的重要手段,因此,要保证药剂学工作能够跟得上医学发展,跟得上临床学的发展,还需要进一步对药剂学的理论研究方法及研究内容进行不断发展更新,让药剂学在临床医学中发挥更大的作用。 展开更多
关键词 药剂学 应用 临床 预测吸收 合理用药
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芝麻降压与抗氧化肽QCKH的构效关系、分子拼接及理化性质研究 被引量:2
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作者 芦鑫 贾聪 +5 位作者 王瑞丹 高锦鸿 张丽霞 孙强 赵谋明 黄纪念 《食品与发酵工业》 CAS CSCD 北大核心 2020年第19期70-77,共8页
为揭示芝麻7S蛋白源的降血压与抗氧化双活性肽QCKH的构效关系、与血管紧张素转换酶(angiotensin I-converting enzyme,ACE)作用机理、理化特性,采用比较分子相似性指数分析法(comparative molecular similarity indices analysis,CoMSIA... 为揭示芝麻7S蛋白源的降血压与抗氧化双活性肽QCKH的构效关系、与血管紧张素转换酶(angiotensin I-converting enzyme,ACE)作用机理、理化特性,采用比较分子相似性指数分析法(comparative molecular similarity indices analysis,CoMSIA)研究构效关系,利用分子拼接揭示QCKH与人体ACE的作用位点,并预测其体内吸收代谢特性,评价外部因素对其活性的影响。结果显示:QCKH的降压性与抗氧化性分别与His4和Cys2有关,氢键与电荷极性是影响活性的主要因素。QCKH通过与ACE的活性口袋S1(Ala354、Tyr523),S2(Gln281、His353、Lys511、His513、Tyr520),活性中心Zn^(2+)及其四面体配位中His387和Glu411发生作用,影响ACE空间结构,引起抑制。ADMET预测QCKH可以经口吸收,不影响体内正常的代谢,安全性高。QCKH在酸性与中性条件下活性稳定,在60℃下也能保持稳定,然而对紫外敏感。研究结果为QCKH的结构修饰与应用研究提供了理论参考。 展开更多
关键词 芝麻7S球蛋白 吸收代谢预测 安全性评价 稳定性评价 氨基酸残基
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Energy-absorption forecast of thin-walled structure by GA-BP hybrid algorithm 被引量:7
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作者 谢素超 周辉 +1 位作者 赵俊杰 章易程 《Journal of Central South University》 SCIE EI CAS 2013年第4期1122-1128,共7页
In order to analyze the influence rule of experimental parameters on the energy-absorption characteristics and effectively forecast energy-absorption characteristic of thin-walled structure, the forecast model of GA-B... In order to analyze the influence rule of experimental parameters on the energy-absorption characteristics and effectively forecast energy-absorption characteristic of thin-walled structure, the forecast model of GA-BP hybrid algorithm was presented by uniting respective applicability of back-propagation artificial neural network (BP-ANN) and genetic algorithm (GA). The detailed process was as follows. Firstly, the GA trained the best weights and thresholds as the initial values of BP-ANN to initialize the neural network. Then, the BP-ANN after initialization was trained until the errors converged to the required precision. Finally, the network model, which met the requirements after being examined by the test samples, was applied to energy-absorption forecast of thin-walled cylindrical structure impacting. After example analysis, the GA-BP network model was trained until getting the desired network error only by 46 steps, while the single BP-ANN model achieved the same network error by 992 steps, which obviously shows that the GA-BP hybrid algorithm has faster convergence rate. The average relative forecast error (ARE) of the SEA predictive results obtained by GA-BP hybrid algorithm is 1.543%, while the ARE of the SEA predictive results obtained by BP-ANN is 2.950%, which clearly indicates that the forecast precision of the GA-BP hybrid algorithm is higher than that of the BP-ANN. 展开更多
关键词 thin-walled structure GA-BP hybrid algorithm IMPACT energy-absorption characteristic FORECAST
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FLAME ATOMIC ABSORPTION DETERMINATION OF COPPER IN CEREALS FOOD SAMPLES WITH THE PRECONCENTRATION OF POTASSIUM TETRATITANATE WHISKER 被引量:1
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作者 XU Wanzhen ZHANG Xinghua +2 位作者 YAN Yongsheng LIU Aiqin JING Junjie 《Chinese Journal of Reactive Polymers》 2007年第1期22-30,共9页
A simple and reliable method has been developed for separation and preconcentration of trace amounts of copper ions in cereals food for subsequent measurement by flame atomic absorption spectrometry (FAAS). The Cu^2... A simple and reliable method has been developed for separation and preconcentration of trace amounts of copper ions in cereals food for subsequent measurement by flame atomic absorption spectrometry (FAAS). The Cu^2+ ions are adsorbed selectively and quantitatively during the passage. The retained copper ions were desorbed from the potassium tetratitanate whisker with 10.0mL of 2mol/L sulphuric acid solutions as eluent and were determined by FAAS. The linear range was 0.05μg/mL-0.20μg/mL in the original solution with a correlation coefficient of 0.9998. The detection limit of the proposed method is 2. lng/mL in the original solution (3σ, n=9). Determination of copper in standard ions showed that the proposed method has good accuracy (recovery was more than 95%). The method was successfully applied for recovery and determination of copper in cereals food samples 展开更多
关键词 Flame atomic absorption spectrometry COPPER Cereals food Potassium tetratitanate whisker.
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基于平行人工膜渗透分析法对药物溶出/吸收仿生系统优化及其药物渗透性评价研究 被引量:7
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作者 王洋洋 黄聪 +3 位作者 王彩君 肖娟兰 刘昌孝 何新 《药物评价研究》 CAS 2019年第8期1544-1550,共7页
目的基于平行人工膜渗透分析法(Parallel artificial membrane permeability analysis, PAMPA)对药物溶出/吸收仿生系统(Drug dissolution and absorption simulating system,DDASS)的生物膜系统进行改进,以单硝酸异山梨酯、奥美拉唑和... 目的基于平行人工膜渗透分析法(Parallel artificial membrane permeability analysis, PAMPA)对药物溶出/吸收仿生系统(Drug dissolution and absorption simulating system,DDASS)的生物膜系统进行改进,以单硝酸异山梨酯、奥美拉唑和氢氯噻嗪为工具药进行渗透性考察,建立一种快速、简便的药物渗透性考察方法,以期进一步提高DDASS系统对药物渗透性评价的效率和准确性,并对药物体内吸收百分率进行预测。方法以疏水性半透膜为载体,将1%大豆卵磷脂和0.1%胆固醇的正十二烷溶液涂于疏水性聚偏氟乙烯中空纤维膜上制备人工渗透膜,以人工渗透膜取代DDASS中的大鼠肠管,以BCS I类药单硝酸异山梨酯,BCS II类药奥美拉唑和BCS III类药氢氯噻嗪为工具药考察其在DDASS系统中经人工渗透膜的表观渗透系数(Papp),采用大鼠在体单向肠灌流法对上述3种药物的有效渗透系数(Peff)的测定,验证人工渗透膜对药物BCS归类的准确性。结果单硝酸异山梨酯、奥美拉唑和氢氯噻嗪基于PAMPA优化DDASS法测得Papp分别为(3.644±0.291)×10^-6、(2.391±0.020)×10^-6、(0.129±0.032)×10^-6cm/s;上述药物基于大鼠在体单向肠灌流法测得Peff分别为(37.69±2.67)×10^-5、(33.72±5.02)×10^-5、(14.37±1.66)×10^-5cm/s。三者的体内吸收百分率预测值分别为95.36%、65.76%、5.61%,与Papp呈正相关。结论基于DDASS优化PAMPA法对3种不同BCS分类药物渗透性的考察结果与大鼠在体单向肠灌流结果一致,均证明单硝酸异山梨酯与奥美拉唑为高渗透性药物,氢氯噻嗪为低渗透性药物,符合FDA对三者的BCS分类。表明基于DDASS优化PAMPA法考察药物渗透性,结果准确,简单方便,节约资源,体内吸收百分率预测值具有参考价值,为仿制药申请生物等效性豁免及为创新药物口服生物利用度研究提供了可靠的体外预测平台。 展开更多
关键词 药物溶出/吸收仿生系统(DDASS) 平行人工膜渗透分析法(PAMPA) 药物渗透性 药物吸收预测
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中上段食管癌调强放疗肺及心脏体积与吸收剂量数学模型建立与验证 被引量:4
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作者 唐涛 庞皓文 +3 位作者 石翔翔 韩云炜 孙小杨 林盛 《中华肿瘤防治杂志》 CAS 北大核心 2020年第7期533-536,共4页
目的随着调强放疗(intensity modulated radiation therapy,IMRT)在食管癌中的广泛应用,肺与心脏的放射损伤也逐渐成为关注焦点。本研究探讨中上段食管癌IMRT中肺和心脏吸收剂量相关因素,并建立相关数学模型,为食管癌IMRT中肺与心脏吸... 目的随着调强放疗(intensity modulated radiation therapy,IMRT)在食管癌中的广泛应用,肺与心脏的放射损伤也逐渐成为关注焦点。本研究探讨中上段食管癌IMRT中肺和心脏吸收剂量相关因素,并建立相关数学模型,为食管癌IMRT中肺与心脏吸收剂量提供预测。方法收集2013-07-01-2017-12-30西南医科大学附属医院肿瘤科收治的50例中上段食管癌IMRT患者资料,分析放疗计划中靶区肺及心脏体积与其吸收剂量的相关关系,并通过SPSS 17.0软件拟合出相关公式。结果肺体积(V肺)与肺的归一化平均剂量(Dnmean=Dmean/D处方)、Dn5%、Dn25%、Dn50%、Dn75%和Dn95%之间具有负相关性,均P<0.05;肺与计划靶区(planning target volume,PTV)的归一化相交体积(Vo-肺/V肺)与肺的Dnmean、Dn5%、Dn25%、Dn50%、Dn75%和Dn95%之间呈正相关性,均P<0.05。心脏体积(V心脏)与心脏的Dnmean、Dn5%、Dn25%、Dn50%、Dn75%和Dn95%之间无相关性,均P>0.05;心脏与PTV的相交体积(Vo-心脏)、心脏的Dnmean、Dn5%、Dn25%、Dn50%、Dn75%和Dn95%之间呈正相关性,均P<0.05。所有拟合公式均P<0.001。结论本研究成功建立中上段食管癌IMRT中肺和心脏吸收剂量预测数学模型,从拟合公式P值看,结果较为精确。不同治疗计划系统均可利用该方法建立适合各自系统的危及器官剂量预测模型,并不需要购买新的软件模块。 展开更多
关键词 食管癌 放射治疗 肺与心脏 吸收剂量的预测
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Predicting Cadmium Safety Thresholds in Soils Based on Cadmium Uptake by Chinese Cabbage 被引量:13
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作者 LU Junhe YANG Xinping +4 位作者 MENG Xuchao WANG Guoqing LIN Yusuo WANG Yujun ZHAO Fangjie 《Pedosphere》 SCIE CAS CSCD 2017年第3期475-481,共7页
Cadmium(Cd), a common toxic heavy metal in soil, has relatively high bioavailability, which seriously threatens agricultural products. In this study, 8 different soils with contrasting soil properties were collected f... Cadmium(Cd), a common toxic heavy metal in soil, has relatively high bioavailability, which seriously threatens agricultural products. In this study, 8 different soils with contrasting soil properties were collected from different regions in China to investigate the Cd transfer coefficient from soil to Chinese cabbage(Brassica chinensis L.) and the threshold levels of Cd in soils for production of Chinese cabbage according to the food safety standard for Cd. Exogenous Cd(0–4 mg kg^(-1)) was added to the soils and equilibrated for 2 weeks before Chinese cabbage was grown under greenhouse conditions. The influence of soil properties on the relationship between soil and cabbage Cd concentrations was investigated. The results showed that Cd concentration in the edible part of Chinese cabbage increased linearly with soil Cd concentration in 5 soils, but showed a curvilinear pattern with a plateau at the highest dose of exogenous Cd in the other 3 soils. The Cd transfer coefficient from soil to plant varied significantly among the different soils and decreased with increasing soil p H from 4.7 to 7.5. However, further increase in soil pH to > 8.0 resulted in a significant decrease in the Cd transfer coefficient. According to the measured Cd transfer coefficient and by reference to the National Food Safety Standards of China, the safety threshold of Cd concentration in soil was predicted to be between 0.12 and 1.7 mg kg^(-1) for the tested soils. The predicted threshold values were higher than the current soil quality standard for Cd in 5 soils, but lower than the standard in the other 3 soils. Regression analysis showed a significant positive relationship between the predicted soil Cd safety threshold value and soil p H in combination with soil organic matter or clay content. 展开更多
关键词 clay content soil pH soil organic matter soil quality standard transfer coefficient
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Prediction of Acoustic Absorption Performance of a Perforated Plate with Air Jets
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作者 Hiromitsu Hamakawa Masanori Miyazaki +3 位作者 Yuta Asai Eru Kurihara Eiichi Nishida Hidechito Hayashi 《Journal of Thermal Science》 SCIE EI CAS CSCD 2017年第4期378-384,共7页
The present study focuses on the prediction of acoustic absorption performance of a perforated plate with air jets by theoretical calculations. In addition, we experimentally measured the flow rate, internal pressure,... The present study focuses on the prediction of acoustic absorption performance of a perforated plate with air jets by theoretical calculations. In addition, we experimentally measured the flow rate, internal pressure, acoustic pressure, and transfer function using an acoustic impedance tube. The normal incidence absorption coefficient was calculated from the measured transfer function using transfer function methods. We investigated the influences of background air space, flow velocity, thickness, aperture rate, and aperture diameter of a perforated plate on the acoustic absorption characteristics. The frequency characteristics of the acoustic absorption coefficient showed a maximum value at a local frequency. As the background air space increased, the peak frequency of acoustic absorption characteristics decreased. As the flow velocity passing through the apertures increased, the peak level of the acoustic absorption coefficient also increased. The theoretical results agreed well with the experimental ones qualitatively. 展开更多
关键词 acoustic absorption perforated plate theoretical prediction acoustic impedance tube air jets
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