全文获取类型
收费全文 | 12133篇 |
免费 | 2141篇 |
国内免费 | 1411篇 |
专业分类
化学 | 8273篇 |
晶体学 | 163篇 |
力学 | 860篇 |
综合类 | 108篇 |
数学 | 1285篇 |
物理学 | 4996篇 |
出版年
2024年 | 40篇 |
2023年 | 289篇 |
2022年 | 487篇 |
2021年 | 568篇 |
2020年 | 523篇 |
2019年 | 527篇 |
2018年 | 449篇 |
2017年 | 398篇 |
2016年 | 642篇 |
2015年 | 612篇 |
2014年 | 721篇 |
2013年 | 854篇 |
2012年 | 1094篇 |
2011年 | 1052篇 |
2010年 | 814篇 |
2009年 | 743篇 |
2008年 | 738篇 |
2007年 | 646篇 |
2006年 | 657篇 |
2005年 | 577篇 |
2004年 | 376篇 |
2003年 | 312篇 |
2002年 | 318篇 |
2001年 | 233篇 |
2000年 | 215篇 |
1999年 | 216篇 |
1998年 | 182篇 |
1997年 | 207篇 |
1996年 | 184篇 |
1995年 | 163篇 |
1994年 | 140篇 |
1993年 | 97篇 |
1992年 | 90篇 |
1991年 | 82篇 |
1990年 | 81篇 |
1989年 | 69篇 |
1988年 | 53篇 |
1987年 | 29篇 |
1986年 | 44篇 |
1985年 | 33篇 |
1984年 | 18篇 |
1983年 | 15篇 |
1982年 | 16篇 |
1981年 | 9篇 |
1980年 | 9篇 |
1975年 | 7篇 |
1973年 | 4篇 |
1972年 | 7篇 |
1965年 | 6篇 |
1964年 | 5篇 |
排序方式: 共有10000条查询结果,搜索用时 9 毫秒
81.
ML/Y分子筛复合材料的制备,表征及其催化性能研究 总被引:2,自引:2,他引:0
采用沸石合成法制备了ML/Y(M= Fe,Co,Cr;L= 8- quinolinoland salicylic acid (denoted asQx and SArespectively)) 复合材料,并通过XRD、FTIR、ICP、UV- vis 及催化反应等手段对其进行了表征。FTIR和UV- vis 测试结果表明: 合成体系中含有的金属配合物经过水热晶化后封装或固定在分子筛的空腔中。通过X射线衍射原位跟踪Y型分子筛的晶化过程,发现合成体系中含有金属配合物的性质及其量的多少不仅对Y型分子筛的晶化有很大影响,而且使其封装或固定在分子筛中的量也有所差异。另外,以环己烷氧化为探针反应考察了ML/Y的催化性能,结果表明ML/Y的氧化能力来自于所封装或固定的金属配合物,其氧化能力主要取决于配合物中心离子的性质 相似文献
82.
The interactions between Trichoderma reesei cellulase and an anionic surfactant, sodium dodecyl sulfate (SDS), at critical micelle concentration level have been investigated using isothermal titration calorimetry, fluorescence spectroscopy, and circular dichroism. SDS micelles have dual interactions with cellulase: electrostatic at first and then hydrophobic interactions. When the concentration of SDS is smaller than 45.0 mM, SDS micelles cause a partial loss in the hydrolytic activity together with a steep decrease in the -helical content of cellulase. With further increasing the concentration of SDS, however, a re-formation of the -helical structure and a partial recovery of the hydrolytic activity of cellulase induced by SDS micelles are observed. Taken together, these results indicate that SDS micelles exert dual effects on cellulase through binding as both a denaturant and a recovery reagent. 相似文献
83.
A high-performance liquid chromatography coupled with an evaporative light scattering detector (HPLC-ELSD) has been developed for the simultaneous determination of seven polyoxypregnane glycosides, tenacissosides A, B, G, H, I and marsdenosides C, G, in the stem of Marsdenia tenacissima, a Chinese herbal medicine. With a C18 analytical column, the analytes were separated efficiently using methanol-water as the mobile phase in a gradient program. The method limits of detection ranged from ca. 0.3 microg for marsdenoside C to ca. 0.5 microg for marsdenoside G and the method limits of quantitation from 1.0 microg for marsdenoside C to 1.7 microg for marsdenoside G, respectively. The intra- and inter-day precisions of the method were evaluated and all were less than 4%. All the recoveries for the spiked analytes exceeded 90%. This method was successfully used to analyze 19 samples of the stem of M. tenacissima. 相似文献
84.
在25℃下分别测定正丙酸和正丁酸在苯相和纯水相中的分配比,以及在苯相和盐水溶液中的分配比,从而求出酸的活度系数。所用的盐有氯化锂、氯化钠、氯化钾、氯化锶、氯化钡、溴化锂、溴化钠、溴化钾等八种。对弱酸算出了未解离部分的活度系数。在所用盐浓度(0-1mol/l)范围内,作lgfu-Cs图,都呈直线。比较直线的斜率,对正丙酸为:SrCl2>BaCl2>LiCl≈NaCl>LiBr≈NaBr>KCl>KBr。对正了酸为:SrCl2>BaCl2>NaCl≈LiC1>NaBr≈KCl≈LiBr>KBr.指出小离子盐对小脂肪酸盐效应主要是静电力作用。 相似文献
85.
Sun YX Huang YX Li FL Wang HY Fan C Bao YL Sun LG Ma ZQ Kong J Li YX 《Chemistry Central journal》2012,6(1):2
Background
The virtual screening (VS) of lead compounds using molecular docking and pharmacophore detection is now an important tool in drug discovery. VS tasks typically require a combination of several software tools and a molecular graphics system. Thus, the integration of all the requisite tools in a single operating environment could reduce the complexity of running VS experiments. However, only a few freely available integrated software platforms have been developed. 相似文献86.
Several rare earth‐doped, calcium‐based magnetic catalysts were prepared for the synthesis of glycerol carbonate. The basicity and basic strength analysis of the catalysts showed that the doping of rare earth improved the basicity of the catalysts, and the doping of lanthanum maximized it. In addition, with the doping of lanthanum, the particle size of the catalyst became smaller to promote the organic reactants near the active sites of catalysts, thereby effectively improving the performance. NiFe2O4@[CaO‐La2O3] shows better catalytic performance with 99.0% yield of glycerol carbonate compared to the other catalysts. The NiFe2O4@(CaO‐La2O3) could be reused in six cycles without significant loss in activity. 相似文献
87.
88.
89.
Ziheng Lu Fan Sui Yue-E Miao Guohua Liu Cheng Li Wei Dong Jiang Cui Tianxi Liu Junxiong Wu Chunlei Yang 《Journal of Energy Chemistry》2021,(7):170-197
Separators are indispensable components of modern electrochemical energy storage devices such as lithium-ion batteries (LIBs).They perform the critical function... 相似文献
90.
Mengzhou Bi Zhen Guan Tengjiao Fan Na Zhang Jianhua Wang Guohui Sun Lijiao Zhao Rugang Zhong 《Molecules (Basel, Switzerland)》2022,27(6)
Dual-specific tyrosine phosphorylation regulated kinase 1 (DYRK1A) has been regarded as a potential therapeutic target of neurodegenerative diseases, and considerable progress has been made in the discovery of DYRK1A inhibitors. Identification of pharmacophoric fragments provides valuable information for structure- and fragment-based design of potent and selective DYRK1A inhibitors. In this study, seven machine learning methods along with five molecular fingerprints were employed to develop qualitative classification models of DYRK1A inhibitors, which were evaluated by cross-validation, test set, and external validation set with four performance indicators of predictive classification accuracy (CA), the area under receiver operating characteristic (AUC), Matthews correlation coefficient (MCC), and balanced accuracy (BA). The PubChem fingerprint-support vector machine model (CA = 0.909, AUC = 0.933, MCC = 0.717, BA = 0.855) and PubChem fingerprint along with the artificial neural model (CA = 0.862, AUC = 0.911, MCC = 0.705, BA = 0.870) were considered as the optimal modes for training set and test set, respectively. A hybrid data balancing method SMOTETL, a combination of synthetic minority over-sampling technique (SMOTE) and Tomek link (TL) algorithms, was applied to explore the impact of balanced learning on the performance of models. Based on the frequency analysis and information gain, pharmacophoric fragments related to DYRK1A inhibition were also identified. All the results will provide theoretical supports and clues for the screening and design of novel DYRK1A inhibitors. 相似文献