含喹唑啉结构的VEGFR-2抑制剂的合成、体外抗肿瘤活性与分子对接研究

为了研究新型VEGFR-2抑制剂的合成方法及抗肿瘤活性,合成了9个含喹唑啉结构的VEGFR-2抑制剂,以MTT法测试了目标化合物对人结肠癌HCT-116和HT-29 2个细胞株的抑制活性,结果显示化合物A03、A05、A06、A07和A08比阳性对照索拉非尼的活性更好(IC_(50)10μmol/L).为了阐明目标化合物和VEGFR-2的作用机制,分别将sorafenib和化合物A03与VEGFR-2(PDB:2OH4)的DFG-out构象进行了分子对接,结果表明该系列化合物可能作为Ⅱ型激酶抑制剂发挥抗肿瘤作用.     

海洋生物膜对混凝土耐久性影响

为研究海洋生物群落附着在混凝土表面形成生物膜对混凝土耐久性能的影响,设置对照实验组,制作标准试块,放置在相应海洋环境中进行侵蚀,分阶段取出试块进行实验,检测混凝土碳化深度,氯离子侵蚀深度以及混凝土扩散系数三个参数,其中将有活性的生物膜,无活性的生物膜及无生物膜试块的混凝土氯离子扩散系数进行对比。有活性的海洋生物膜对混凝土碳化及氯离子侵蚀起到一定的抑制作用。为桥梁养护提供新的方法建议。采用MATLAB较好的拟合有生物膜与无生物膜扩散系数的关系,以便基于现有氯离子扩散系数模型推测有生物膜的氯离子扩散模型。     

丹参酮类化合物对醛糖还原酶抑制作用的研究

从西藏灵芝丹参的脂溶性提取物中分离出了12个丹参酮类化合物,并对这些化合物对牛晶状体醛糖还原酶的抑制作用进行了研究,结果表明丹参酮类化合物对醛糖还原酶均具有较强的抑制作用,其中带有半醌结构的丹参酮类化合物化合物S6、S7、S8、及S9对醛糖还原酶的抑制作用活性最强,IC50值分别为32.9μmol/L、36.5μmol/L、34.9μmol/L和39.6μmol/L。     

熊果酸/甘草次酸-尿嘧啶核苷缀合物的合成与抗肿瘤活性评价

合成新型熊果酸和甘草次酸-尿嘧啶核苷缀合物,并研究其体外抗肿瘤活性。以熊果酸和甘草次酸为原料,在碱性条件下,与二溴烷烃反应生成溴代烷烃酯;继而与尿嘧啶核苷发生亲核取代反应,共合成得到4个新型的熊果酸/甘草次酸-尿嘧啶核苷缀合物,并采用MTT法测试其抗肿瘤活性。结果表明,甘草次酸-尿嘧啶核苷缀合物对人肝癌细胞HepG-2和人肺癌细胞A549的抑制作用比熊果酸-尿嘧啶核苷缀合物强;4个目标化合物均对人胃癌细胞BGC-823具有较好的抑制作用([(3-尿嘧啶核苷酸)-正辛基]-甘草次酸酯活性最高,20μmol/L抑制率约64%),而对NCI-H460、BEL-7404等肿瘤细胞抑制作用不明显;化合物([(3-尿嘧啶核苷基)-正辛基]-熊果酸酯对人宫颈癌细胞HeLa表现出较好的抑制作用(20μmol/L抑制率约54%)。     

生物膜和生物膜形成菌的研究

细菌生物膜是一个复杂的微生物群落,生物膜巾除了水和细菌以外,还含有细菌分泌的胞外聚合物、吸附的营养物质、代谢产物及DNA等细菌裂解产物.介绍细菌生物膜的形成过程,并综述了近年来医学领域以几种成膜力强的条件致病菌为研究对象,从基因水平上证实了细菌细胞表面结构鞭毛、纤毛、胞外聚合物和群体感应信号分子等细胞因子对生物膜形成的影响.     

鞭打绣球的化学成分及其α-葡萄糖苷酶抑制活性的研究

利用硅胶柱色谱、Sephadex LH-20等色谱法从鞭打绣球的95%乙醇提取物的乙酸乙酯部分中分离得到10个化合物.根据化合物的理化性质和~1H NMR、~(13)C NMR鉴定化合物为齐墩果酸(1),β-谷甾醇(2),紫丁香苷(3),苯基β-D-吡喃葡萄糖苷(4),苄基β-D-吡喃葡萄糖苷(5),熊果苷(6),草夹竹桃苷(7),反式肉桂酸(8),顺式肉桂酸(9),丁香醛(10).其中化合物3～7和10为首次从该植物中获得.通过体外α-葡萄糖苷酶抑制模型对以上化合物进行活性筛选,结果显示化合物1和10对α-葡萄糖苷酶活性具有一定的抑制作用, IC_(50)值分别为(68.93±6.20)μmol/L、(71.77±6.46)μmol/L.     

2,4-噻唑烷二酮衍生物抑制酪氨酸酶活性研究

以2,4-噻唑烷二酮和取代芳香醛为起始原料,反应得到一系列2,4-噻唑烷二酮衍生物,并对所合成化合物进行了抑制酪氨酸酶活性测试,结果表明化合物均有一定的抑制酪氨酸酶活性,化合物1((E)-5-(3-氯苯亚甲基)噻唑烷-2,4-二酮)和化合物2((E)-5-(2,4-二氯苯亚甲基)噻唑烷-2,4-二酮)活性强于阳性对照曲酸,其中化合物1表现出最好的抑制酪氨酸酶活性,其IC_(50)值为18. 43μmol/L。优选化合物1进行了抑制机理探讨,结果表明其为不可逆抑制剂,同时对化合物1进行了分子对接研究。     

光甘草定的制备及其对蘑菇酪氨酸酶的抑制作用

分别选用单酚酶与二酚酶为底物,评价硅胶柱层析(CHCl3/MeOH梯度洗脱)分离得到的光甘草定对蘑菇酪氨酸酶活性的影响。结果表明:实验室所分离得到的光甘草定纯度为85%以上,其对蘑菇酪氨酸酶单酚酶和二酚酶的活性均有抑制作用,导致酶活力下降50%的抑制剂浓度(IC50)分别为1.28μmol/L和1.56μmol/L,且Lin-eweaver-Burk图显示,光甘草定对酪氨酸酶二酚酶活性的抑制作用表现为竞争型抑制。光甘草定发挥着显著的抑制酪氨酸酶活性,说明光甘草定可以通过抑制黑色素生成的限速酶-酪氨酸酶达到美白肌肤之功效。     

类姜黄素化合物的合成及对蛋白质非酶糖基化抑制活性的研究

通过芳香醛和环己酮及丙酮在乙酸-HC l催化缩合制备了两个系列(A、C)类姜黄素化合物,多酚羟基类姜黄素不需经过羟基保护一步直接缩合制得。对所合成的类姜黄素化合物对牛血清白蛋白非酶糖基化的抑制活性进行了研究,结果表明带酚羟基的类姜黄素均表现出一定的非酶糖基化的抑制活性,四羟基类姜黄素A2及C2表现出极强的非酶糖基化的抑制活性,IC50分别为5.1μmol/L和9.4μmol/L。     

Shewanella algae对纯锌腐蚀性能的影响

【目的】在室内模拟条件下研究海藻希瓦氏菌(Shewanella algae)对纯锌牺牲阳极腐蚀的影响。【方法】利用微生物分析、交流阻抗测试技术、扫描电镜及荧光显微等方法,测试Shewanella algae的生长曲线、开路电位、电化学阻抗、表面形貌等。【结果】在含细菌体系中,细菌通过代谢活动消耗掉溶解氧,在试样表面形成一层生物膜。该生物膜阻挡了腐蚀介质与试样表面的接触,从而使试样的腐蚀受到抑制。荧光显微镜观察结果表明,浸泡7d,试样表面形成完整的生物膜,但随着营养物质及氧气的消耗,生物膜逐渐脱落。【结论】该细菌可以使纯锌试样的腐蚀电位升高,并且显著抑制试样的腐蚀。该细菌生物膜的形成需要一定的时间及充足的营养物质和氧气。     

Characterization of Ordovician carbonate reservoirs, southeastern Saskatchewan, Canada

The discovery of the prolific Ordovician Red River reservoirs in 1995 in southeastern Saskatchewan was the catalyst for extensive exploration activity which resulted in the discovery of more than 15 new Red River pools. The best yields of Red River production to date have been from dolomite reservoirs. Understanding the processes of dolomitization is, therefore, crucial for the prediction of the connectivity, spatial distribution and heterogeneity of dolomite reservoirs.The Red River reservoirs in the Midale area consist of 3～4 thin dolomitized zones, with a total thickness of about 20 m, which occur at the top of the Yeoman Formation. Two types of replacement dolomite were recognized in the Red River reservoir: dolomitized burrow infills and dolomitized host matrix. The spatial distribution of dolomite suggests that burrowing organisms played an important role in facilitating the fluid flow in the backfilled sediments. This resulted in penecontemporaneous dolomitization of burrow infills by normal seawater. The dolomite in the host matrix is interpreted as having occurred at shallow burial by evaporitic seawater during precipitation of Lake Almar anhydrite that immediately overlies the Yeoman Formation. However, the low δ18O values of dolomited burrow infills (-5.9‰～ -7.8‰, PDB) and matrix dolomites (-6.6‰～ -8.1‰, avg. -7.4‰ PDB) compared to the estimated values for the late Ordovician marine dolomite could be attributed to modification and alteration of dolomite at higher temperatures during deeper burial, which could also be responsible for its 87Sr/86Sr ratios (0.7084～0.7088) that are higher than suggested for the late Ordovician seawaters (0.7078～0.7080). The trace amounts of saddle dolomite cement in the Red River carbonates are probably related to "cannibalization" of earlier replacement dolomite during the chemical compaction.     

A computer generator for randomly layered structures

AcomputergeneratorforrandomlylayeredstructuresYUJia shun1,2,HEZhen hua2(1.TheInstituteofGeologicalandNuclearSciences,NewZealand;2.StateKeyLaboratoryofOilandGasReservoirGeologyandExploitation,ChengduUniversityofTechnology,China)Abstract:Analgorithmisintrod…     

海南岛地体及其毗邻陆缘晚中生代—新生代古地磁研究和构造演化

本文叙述了对海南岛及其毗邻大陆边缘白垩纪到第四纪地层岩石进行古地磁研究的全部工作过程。通过分析岩石中剩余磁矢量的磁偏角及磁倾角的变化,提出海南岛白垩纪以来经历的构造演化模式如下:早期伴随顺时针旋转而向南迁移,后期伴随逆时针转动并向北运移。联系该地区及邻区的地质、地球物理资料,对海南岛上述的构造地体运动提出以下认识:北部湾内早期有一拉张作用,主要是该作用使湾内地壳显著伸长减薄,形成北部湾盆地。从而导致了海南岛的早期构造运动,而海南岛后期的构造运动则主要是受南海海底扩张的影响。海南地体运动规律的阐明对于了解北部湾油气盆地的形成演化有重要的理论和实际意义。     

Exciton Seebeck in Molecular Systems

Various applications relevant to the exciton dynamics,such as the organic solar cell,the large-area organic light-emitting diodes and the thermoelectricity,are operating under temperature gradient.The potential abnormal behavior of the exicton dynamics driven by the temperature difference may affect the efficiency and performance of the corresponding devices.In the above situations,the exciton dynamics under temperature difference is mixed with     

Achieving Unusual States of Matter Under High Pressure

The elongation method,originally proposed by Imamura was further developed for many years in our group.As a method towards O(N)with high efficiency and high accuracy for any dimensional systems.This treatment designed for one-dimensional(ID)polymers is now available for three-dimensional(3D)systems,but geometry optimization is now possible only for 1D-systems.As an approach toward post-Hartree-Fock,it was also extended to     

《Chinese Science Bulletin》SUBJECT INDEX TO VOLUME 59(2014)

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An on-line scaling method for improving scalability of a database cluster

The explosive growth of the Internet and database applications has driven database to be more scalable and available, and able to support on-line scaling without interrupting service. To support more client's queries without downtime and degrading the response time, more nodes have to be scaled up while the database is running. This paper presents the overview of scalable and available database that satisfies the above characteristics. And we propose a novel on-line scaling method. Our method improves the existing on-line scaling method for fast response time and higher throughputs. Our proposed method reduces unnecessary network use, i.e. , we decrease the number of data copy by reusing the backup data. Also, our on-line scaling operation can be processed parallel by selecting adequate nodes as new node. Our performance study shows that our method results in significant reduction in data copy time.     

An improved R-tree based on childnode''s probability

R-Tree is a good structure for spatial searching. But in this indexing structure,either the sequence of nodes in the same level or sequence of traveling these nodes when queries are made is random. Since the possibility that the object appears in different MBR which have the same parents node is different, if we make the subnode who has the most possibility be traveled first, the time cost will be decreased in most of the cases. In some case, the possibility of a point belong to a rectangle will shows direct proportion with the size of the rectangle. But this conclusion is based on an assumption that the objects are symmetrically distributing in the area and this assumption is not always coming into existence. Now we found a more direct parameter to scale the possibility and made a little change on the structure of R-tree, to increase the possibility of founding the satisfying answer in the front sub trees. We names this structure probability based arranged R-tree (PBAR-tree).     

Integrating GIS Web services based on mediating architecture

The geographic information service is enabled by the advancements in general Web service technology and the focused efforts of the OGC in defining XML-based Web GIS service. Based on these models, this paper addresses the issue of services chaining,the process of combining or pipelining results from several interoperable GIS Web Services to create a customized solution. This paper presents a mediated chaining architecture in which a specific service takes responsibility for performing the process that describes a service chain. We designed the Spatial Information Process Language (SIPL) for dynamic modeling and describing the service chain, also a prototype of the Spatial Information Process Execution Engine (SIPEE) is implemented for executing processes written in SIPL. Discussion of measures to improve the functionality and performance of such system will be included.     

Tracking data management using topology of moving object database system for moving object constrained trajectory in LBS application

Advances in wireless technologies and positioning technologies and spread of wireless devices, an interest in LBS (Location Based Service) is arising. To provide location based service, tracking data should have been stored in moving object database management system (called MODBMS) with proper policies and managed efficiently. So the methods which acquire the location information at regular time intervals then, store and manage have been studied. In this paper, we suggest tracking data management techniques using topology that is corresponding to the moving path of moving object. In our techniques, we update the MODBMS when moving object arrived at a street intersection or a curved road which is represented as the node in topology and predict the location at past and future with attribute of topology and linear function. In this technique, location data that are corresponding to the node in topology are stored, thus reduce the number of update and amount of data. Also in case predicting the location,because topology are used as well as existing location information, accuracy for prediction is increased than applying linear function or spline function.