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91.
Julio Llorca‐Porcel Esther Martínez‐Soriano Ignacio Valor 《Journal of separation science》2009,32(9):1425-1429
An optimised method using stir bar sorptive extraction (SBSE) and a thermal desorption‐GC‐electron capture detector (GC‐ECD) for the determination of short‐chain chlorinated paraffins from water samples was developed. Recoveries near to 100% were obtained by using 20 mm×0.5 mm (length×film thickness) PDMS commercial stir bars from 200 mL spiked water samples and 20% methanol addition with an extraction period of 24 h. Method sensitivity, linearity and precision were evaluated for surface water and wastewater spiked samples. A LOD of 0.03 and 0.04 μg/L was calculated for surface and wastewater, respectively. The precision of the method given as an RSD was below 20% for both matrices. The developed method was applied for the analysis of two real samples from a contaminated river and a wastewater treatment plant. Results were in accordance with those obtained using a previously developed method based on solid phase microextraction (SPME). 相似文献
92.
Julio Becerra Guerrero ngel Rodríguez Palacios 《Journal of Mathematical Analysis and Applications》2009,360(1):108-118
Almost transitive superreflexive Banach spaces have been considered in [C. Finet, Uniform convexity properties of norms on superreflexive Banach spaces, Israel J. Math. 53 (1986) 81–92], where it is shown that they are uniformly convex and uniformly smooth. We characterize such spaces as those convex transitive Banach spaces satisfying conditions much weaker than that of uniform convexity (for example, that of having a weakly locally uniformly rotund point). We note that, in general, the property of convex transitivity for a Banach space is weaker than that of almost transitivity. 相似文献
93.
Seonah Kim Anita M. Orendt Marta B. Ferraro Julio C. Facelli 《Journal of computational chemistry》2009,30(13):1973-1985
This article describes the application of our distributed computing framework for crystal structure prediction (CSP) the modified genetic algorithms for crystal and cluster prediction (MGAC), to predict the crystal structure of flexible molecules using the general Amber force field (GAFF) and the CHARMM program. The MGAC distributed computing framework includes a series of tightly integrated computer programs for generating the molecule's force field, sampling crystal structures using a distributed parallel genetic algorithm and local energy minimization of the structures followed by the classifying, sorting, and archiving of the most relevant structures. Our results indicate that the method can consistently find the experimentally known crystal structures of flexible molecules, but the number of missing structures and poor ranking observed in some crystals show the need for further improvement of the potential. © 2009 Wiley Periodicals, Inc. J Comput Chem, 2009 相似文献
94.
Isidro S. Marcos Rosalina F. Moro Isabel Costales Miguel A. Escola Pilar Basabe David Díez Julio G. Urones 《Tetrahedron》2009,65(49):10235-1011
A new cyclisation of 3-(but-3-enyl) indole derivatives that produces policyclic compounds with a hexahydrocarbazole structure is described. In this reaction three stereogenic centres are generated in one step, and this process can be considered as evidence of the biogenetic relationship between anominine and tubingensin A. 相似文献
95.
Jan Janczak Genivaldo Julio Perptuo 《Acta Crystallographica. Section C, Structural Chemistry》2004,60(3):o211-o214
In the title compound, 2,4,6‐triamino‐1,3,5‐triazin‐1‐ium maleate monohydrate, C3H7N6+·C4H3O4−·H2O, containing singly protonated melaminium residues, maleate(1−) anions and water molecules, the components are linked by hydrogen bonds into a three‐dimensional framework structure. The melaminium residues are connected by two pairs of N—H⋯N hydrogen bonds into chains in the form of stacks, with a distance of 3.26 (1) Å between the triazine rings, clearly indicating π–π interactions. The maleate anion contains an intramolecular O—H⋯O hydrogen bond and the anions interact with the water molecules via O—H⋯O hydrogen bonds, forming zigzag chains, also in the form of stacks, in which the almost‐planar maleate anions are separated by 3.26 (1) Å. The experimental geometries of the ions are compared with molecular‐orbital calculations of their gas‐phase geometries. 相似文献
96.
Suihan Feng Dr. Vibor Laketa Frank Stein Dr. Anna Rutkowska Dr. Aidan MacNamara Dr. Sofia Depner Prof. Ursula Klingmüller Dr. Julio Saez‐Rodriguez Priv.‐Doz. Dr. Carsten Schultz 《Angewandte Chemie (International ed. in English)》2014,53(26):6720-6723
Chemical dimerizers are powerful tools for non‐invasive manipulation of enzyme activities in intact cells. Here we introduce the first rapidly reversible small‐molecule‐based dimerization system and demonstrate a sufficiently fast switch‐off to determine kinetics of lipid metabolizing enzymes in living cells. We applied this new method to induce and stop phosphatidylinositol 3‐kinase (PI3K) activity, allowing us to quantitatively measure the turnover of phosphatidylinositol 3,4,5‐trisphosphate (PIP3) and its downstream effectors by confocal fluorescence microscopy as well as standard biochemical methods. 相似文献
97.
Susana Araceli Carrizales Álvarez Anna Ilyina Karla Monzerratt Gregorio Jáuregui José Luis Martínez Hernández Brenda Berenice Vazquez Gutiérrez Elda Patricia Segura Ceniceros Alejandro Zugasti Cruz Hened Saade Caballero Raúl Guillermo López Campos 《Applied biochemistry and biotechnology》2014,174(5):1945-1958
Avian influenza viruses preferentially bind to sialic acid alpha-2,3-galactose (N-SA-α-2,3-Gal) receptors on epithelial cells. Herein, we describe a procedure we have developed for isolation of N-SA-α-2,3-Gal receptors from porcine trachea using magnetic nanoparticles (NPs) coated with chitosan (NP-Ch) and functionalized with Maackia amurensis lectin (NP-lectin). Magnetic nanoparticles were coated with chitosan in a one-step co-precipitation, and then M. amurensis lectin was immobilized covalently using glutaraldehyde. Lectin coated nanoparticles were incubated with sialic acid enriched fraction of tracheal homogenate, and N-SA-α-2,3-Gal receptor was extracted under magnetic field in two cycles. The presence of 66.4 kDa protein was determined by sodium dodecyl sulfate polyacrylamide gel electrophoresis (SDS-PAGE). The interaction of immobilized receptor (NP-Ch-R) with M. amurensis lectin (NP-Ch-R-L) was demonstrated by Fourier transform infrared spectrometry (FTIR) and thermogravimetric analysis (TGA). 相似文献
98.
99.
Julio Garcia Michael Markl Susanne Schnell Bradley Allen Pegah Entezari Riti Mahadevia S. Chris Malaisrie Philippe Pibarot James Carr Alex J. Barker 《Magnetic resonance imaging》2014
Aims
The objective of this study was to evaluate the potential of 4D flow MRI to assess valve effective orifice area (EOA) in patients with aortic stenosis as determined by the jet shear layer detection (JSLD) method.Methods and Results
An in-vitro stenosis phantom was used for validation and in-vivo imaging was performed in 10 healthy controls and 40 patients with aortic stenosis. EOA was calculated by the JSLD method using standard 2D phase contrast MRI (PC-MRI) and 4D flow MRI measurements (EOAJSLD-2D and EOAJSLD-4D, respectively). As a reference standard, the continuity equation was used to calculate EOA (EOACE) with the 2D PC-MRI velocity field and compared to the EOAJSLD measurements. The in-vitro results exhibited excellent agreement between flow theory (EOA = 0.78 cm2) and experimental measurement (EOAJSLD-4D = 0.78 ± 0.01 cm2) for peak velocities ranging from 0.9 to 3.7 m/s. In-vivo results showed good correlation and agreement between EOAJSLD-2D and EOACE (r = 0.91, p < 0.001; bias: − 0.01 ± 0.38 cm2; agreement limits: 0.75 to − 0.77 cm2), and between EOAJSLD-4D and EOACE (r = 0.95, p < 0.001; bias: − 0.09 ± 0.26 cm2; limits: 0.43 to − 0.62 cm2).Conclusion
This study demonstrates the feasibility of measuring EOAJSLD using 4D flow MRI. The technique allows for optimization of the EOA measurement position by visualizing the 3D vena contracta, and avoids potential sources of EOACE measurement variability. 相似文献100.
Libia L. Julio Jesus Lezama Alexis Maldonado José R. Mora Gabriel Chuchani 《Journal of Physical Organic Chemistry》2014,27(5):450-455
The kinetics of the gas‐phase elimination of α‐methyl‐trans‐cinamaldehyde catalyzed by HCl in the temperature range of 399.0–438.7 °C, and the pressure range of 38–165 Torr is a homogeneous, molecular, pseudo first‐order process and undergoing a parallel reaction to produce via (A) α‐methylstyrene and CO gas and via (B) β‐methylstyrene and CO gas. The decomposition of substrate E‐2‐methyl‐2‐pentenal was performed in the temperature range of 370.0–410.0 °C and the pressure range of 44–150 Torr also undergoing a molecular, pseudo first‐order reaction gives E‐2‐pentene and CO gas. These reactions were carried out in a static system seasoned reactions vessels and in the presence of toluene free radical inhibitor. The rate coefficients are given by the following Arrhenius expressions:
- Products formation from α‐methyl‐trans‐cinamaldehyde
- α‐methylstyrene :
- β‐methylstyrene :
- Products formation from E‐2‐methyl‐2‐pentenal
- E‐2‐pentene :