全文获取类型
收费全文 | 3936篇 |
免费 | 202篇 |
国内免费 | 407篇 |
专业分类
化学 | 2960篇 |
晶体学 | 69篇 |
力学 | 33篇 |
综合类 | 26篇 |
数学 | 604篇 |
物理学 | 853篇 |
出版年
2023年 | 23篇 |
2022年 | 53篇 |
2021年 | 82篇 |
2020年 | 72篇 |
2019年 | 176篇 |
2018年 | 231篇 |
2017年 | 72篇 |
2016年 | 98篇 |
2015年 | 77篇 |
2014年 | 122篇 |
2013年 | 262篇 |
2012年 | 148篇 |
2011年 | 222篇 |
2010年 | 213篇 |
2009年 | 310篇 |
2008年 | 272篇 |
2007年 | 256篇 |
2006年 | 241篇 |
2005年 | 213篇 |
2004年 | 206篇 |
2003年 | 146篇 |
2002年 | 163篇 |
2001年 | 115篇 |
2000年 | 70篇 |
1999年 | 55篇 |
1998年 | 62篇 |
1997年 | 47篇 |
1996年 | 61篇 |
1995年 | 58篇 |
1994年 | 70篇 |
1993年 | 61篇 |
1992年 | 48篇 |
1991年 | 29篇 |
1990年 | 26篇 |
1989年 | 19篇 |
1988年 | 21篇 |
1987年 | 16篇 |
1986年 | 15篇 |
1985年 | 9篇 |
1984年 | 13篇 |
1983年 | 5篇 |
1982年 | 10篇 |
1981年 | 13篇 |
1980年 | 10篇 |
1979年 | 16篇 |
1978年 | 11篇 |
1977年 | 7篇 |
1976年 | 8篇 |
1975年 | 4篇 |
1973年 | 3篇 |
排序方式: 共有4545条查询结果,搜索用时 46 毫秒
81.
Nourallah Hazeri Malek Taher Maghsoodlou Sayyed Mostafa Habibi‐Khorassani Jasem Aboonajmi Seyed Sajad Sajadikhah 《中国化学会会志》2013,60(4):355-358
Fe(NO3)3·9H2O is used as an efficient and effective catalyst for the one‐pot three‐component synthesis of highly functionalized piperidines from aromatic aldehydes, anilines and b–ketoesters in ethanol at ambient temperature. This procedure includes some important aspects like the easy work‐up, no need to column chromatography, simple and readily available precursors, and good to high yields. 相似文献
82.
Masahiro Yodoshi Natsumi Ikeda Naoko Yamaguchi Mana Nagata Noriaki Nishida Kazuaki Kakehi Takao Hayakawa Shigeo Suzuki 《Electrophoresis》2013,34(22-23):3198-3205
We have identified novel CE conditions for the separation of 7‐amino‐4‐methylcoumarin‐labeled monosaccharides and oligosaccharides from glycoproteins. Using a neutrally coated capillary and alkaline borate buffer containing hydroxypropylcellulose and ACN, saccharide derivatives form anionic borate complexes, which move from the cathode to the anode in an electric field and are detected near the anodic end. Excess labeling reagents and other fluorescent products remain at the cathodic end. Fluorimetric detection using an LED as a light source enables determination of monosaccharide derivatives with good linearity between at least 0.4 and 400 μM, may correspond to 140 amol to 140 fmol. The lower LOD (S/N = 5) is only 80 nM in the sample solution (ca. 28 amol). The results were comparable to reported values using fluorometric detection LC. The method was also applied to the analysis of oligosaccharides that were enzymatically released from glycoproteins. Fine resolution enables profiling of glycans in glycoproteins. The applicability of the method was examined by applying it to other derivatives labeled with nonacidic tags such as ethyl p‐aminobenzoate‐ and 2‐aminoacridone‐labeled saccharides. 相似文献
83.
A variety of aldehyde N,N-dimethylhydrazones are rapidly converted into the corresponding nitriles using oxone supported on wet Al2O3 under microwave irradiation in dry media. 相似文献
84.
《合成通讯》2013,43(10):1791-1799
Abstract A simple method for the preparation of 7‐alkoxy/hydroxy‐α‐methyl‐DL‐tryptamines is reported. The key steps of the synthesis are the Japp–Klingemann coupling of 2‐piperidone‐3‐carboxylic acid 3 with diazonium salts 4, the Fischer‐type cyclization of hydrazones 5 to β‐carboline derivatives 6 and their hydrolysis to title compounds 8. 相似文献
85.
Xiaohua Zhang Sergio E. Wong Felice C. Lightstone 《Journal of computational chemistry》2013,34(11):915-927
A mixed parallel scheme that combines message passing interface (MPI) and multithreading was implemented in the AutoDock Vina molecular docking program. The resulting program, named VinaLC, was tested on the petascale high performance computing (HPC) machines at Lawrence Livermore National Laboratory. To exploit the typical cluster‐type supercomputers, thousands of docking calculations were dispatched by the master process to run simultaneously on thousands of slave processes, where each docking calculation takes one slave process on one node, and within the node each docking calculation runs via multithreading on multiple CPU cores and shared memory. Input and output of the program and the data handling within the program were carefully designed to deal with large databases and ultimately achieve HPC on a large number of CPU cores. Parallel performance analysis of the VinaLC program shows that the code scales up to more than 15K CPUs with a very low overhead cost of 3.94%. One million flexible compound docking calculations took only 1.4 h to finish on about 15K CPUs. The docking accuracy of VinaLC has been validated against the DUD data set by the re‐docking of X‐ray ligands and an enrichment study, 64.4% of the top scoring poses have RMSD values under 2.0 Å. The program has been demonstrated to have good enrichment performance on 70% of the targets in the DUD data set. An analysis of the enrichment factors calculated at various percentages of the screening database indicates VinaLC has very good early recovery of actives. © 2013 Wiley Periodicals, Inc. 相似文献
86.
以磷铁废渣(Fe1.5P)和温室效应气体CO2为原料,以磷酸为补充磷源合成磷酸铁锂(LiFePO4)的前驱体Fe2P2O7,并研究了其合成过程对LiFePO4正极材料储能性能的影响。采用SEM观察了LiFePO4的表面形貌,采用XRD分析了LiFePO4和Fe2P2O7的晶体结构。进一步对该方法进行优化,发现Fe1.5P与磷酸混合物(nFe1.5P:nH3PO4=1:1)在800℃热处理6 h合成的Fe2P2O7对应的LiFePO4/C电化学性能最好,在0.1C,0.2C,0.5C和1C倍率下的容量分别可达130,126,117和108 mAh·g-1。该方法具有成本低廉,减少碳排放和环境友好等特点,为LiFePO4正极材料的生产提出了一种新的工艺。 相似文献
87.
88.
以P123(聚环氧乙烷-聚环氧丙烷-聚环氧乙烷三嵌段共聚物)为模板剂,Ce(NO3)3为反应原料,通过考察加热方式、加热温度、原料配比等因素,合成了结构性能较好、表面羟基含量较高的介孔CeO2材料。利用XRD,N2吸附-脱附,TEM,Raman,FT-IR等技术对合成样品的结构性能进行了表征,结果表明,当P123与Ce(NO3)3物质的量之比为1:10,在110℃水热下合成的CeO2结构性能最好。以酸性橙7(AO7)为探针分子,对合成介孔CeO2的光催化性能进行评价。光催化结果证明,由于表面羟基含量较高、介孔及氧缺位的形成,所合成结构性能较好的CeO2,利用可见光可彻底催化降解溶液中的AO7。 相似文献
89.
90.
1, 1 -二氨基- 2, 2 -二硝基乙烯(FOX-7)是一款新型高能钝感炸药, 为了研究温度变化对其分子结构特性的影响, 利用太赫兹时域光谱技术对持续升温(298K→393 K)过程中FOX-7 在0.2—2.5 THz 频率范围内的吸收光谱进行了在线探测, 结果发现随着样品温度的升高, FOX-7 的吸收谱带发生变化, 于384 K 时出现一个新的吸收特征峰, 且该吸收峰的峰强逐渐升高. 基于密度泛函理论(DFT), 对样品在298 K 和393 K 温度下的晶体结构进行了小于2.5 THz 范围内吸收频谱的模拟计算, 完成了对FOX-7 两种晶型实验吸收特征峰的指认. 分析表明FOX-7 的分子结构会受温度的影响而发生改变, 互为异构晶型的基团表现出的振动模式不同, 温度384 K 时FOX-7 开始发生α→β 晶型转变, 且该晶型转变过程是可逆的, 新出现的1.12 THz 特征峰在393 K 时的振动是由—NO2 和—NH2 的摆动及各自的扭动所致. 相似文献