全文获取类型
收费全文 | 368篇 |
免费 | 15篇 |
专业分类
化学 | 263篇 |
晶体学 | 2篇 |
力学 | 13篇 |
数学 | 32篇 |
物理学 | 73篇 |
出版年
2023年 | 3篇 |
2022年 | 9篇 |
2021年 | 24篇 |
2020年 | 13篇 |
2019年 | 10篇 |
2018年 | 9篇 |
2017年 | 7篇 |
2016年 | 18篇 |
2015年 | 16篇 |
2014年 | 21篇 |
2013年 | 30篇 |
2012年 | 20篇 |
2011年 | 27篇 |
2010年 | 14篇 |
2009年 | 18篇 |
2008年 | 21篇 |
2007年 | 19篇 |
2006年 | 20篇 |
2005年 | 11篇 |
2004年 | 12篇 |
2003年 | 10篇 |
2002年 | 7篇 |
2001年 | 4篇 |
2000年 | 5篇 |
1999年 | 2篇 |
1998年 | 3篇 |
1997年 | 3篇 |
1996年 | 4篇 |
1995年 | 6篇 |
1994年 | 2篇 |
1993年 | 1篇 |
1992年 | 1篇 |
1991年 | 2篇 |
1990年 | 1篇 |
1988年 | 3篇 |
1985年 | 1篇 |
1984年 | 1篇 |
1983年 | 1篇 |
1982年 | 2篇 |
1981年 | 2篇 |
排序方式: 共有383条查询结果,搜索用时 31 毫秒
1.
Ricardo Amorim 《Zeitschrift fur Physik C Particles and Fields》1995,67(4):695-700
We study the Hamiltonian path integral formulation for generic systems with first class and linear second class constraints.ift01001@ufrj 相似文献
2.
Ricardo de Souza Pereira Nivaldo AntÔnio Parizotto Vitor Baranauskas 《Applied biochemistry and biotechnology》1996,59(2):135-143
Different strains of baker’s yeast(Saccharomyces cerevisiae) were imaged with an atomic force microscope (AFM). The images of uncoated and nonfixed samples were reproducible with high-constrast
and nanometer-resolution. Molecules from the polysaccharide surface of the cell wall were pictured and the distance of atoms
was measured. The preparation of samples was easy, suggesting that AFM is a useful tool in this type of analyses. 相似文献
3.
The new Pd(II), Pt(II), Re(V), Mo(VI) and W(VI) complexes of 2-hydroxynicotinic acid (H2nicO), trans-[PdCl(HnicO)(PPh3)2]·0.75CH3CN (1), K[PdCl(HnicO)2]·H2O (2), [Pd(HnicO)2(bipy)] (3), cis-[PtCl(HnicO)(PPh3)2]·0.75CH3OH·0.5H2O (4), [PtCl(HnicO)(bipy)] (5), cis-[ReOI2(HnicO)(PPh3)] (6), Na2[Mo2O6(HnicO)2]·5H2O (7), Na2[Mo4O12(HnicO)2]·2H2O (8) and Na2[W2O6(HnicO)2]·5H2O (9) have been prepared. The crystal structures of 1 and 4, were determined by X-ray diffraction and show the HnicO− ligand coordinated to palladium or platinum through the nitrogen atom only. Infrared, Raman, 1H and 13C{1H} NMR spectroscopic data for the complexes are presented and are in agreement with the crystallographic results. 相似文献
4.
Josinira A. Amorim Osvaldo Chiavone-Filho Márcio L.L. Paredes Krishnaswamy Rajagopal 《Fluid Phase Equilibria》2007
High-pressure density data for cyclohexane + n-hexadecane mixtures at a wide temperature range was modeled with several classical equations of state (EOS) and correlative models. A modification for softening the co-volume and another for a volume scaling of the Peng–Robinson EOS (VS-PR) were proposed. The VS-PR model is able to correlate the pure component experimental data employing only five adjustable parameters, with root-mean-square deviation (RMSD) between calculated and experimental densities essentially within the experimental error. This result is superior to widely used approaches, i.e., a six parameter Tait model and six parameter volume translations (temperature and pressure dependent) for Peng–Robinson and Patel–Teja EOS. The VS-PR model also represents well the isobaric thermal expansion and the isothermal compressibility coefficients of the pure cyclohexane, a small naphthenic substance as well as a long chain n-alkane hydrocarbon, n-hexadecane. When modeling the mixture data, the use of VS-PR model of pure components along with the Redlich–Kister expansion, truncated at the first term, the density was correlated within a RMSD only 60% greater than the experimental error. The proposed model is able to accurately represent all the tested mixture data with a relatively small number of parameters. 相似文献
5.
Julliane Diniz Yoneda Magaly Giro Albuquerque Ktia Zaccur Leal Peter R. Seidl Ralph A. Wheeler Scott E. Boesch Ricardo Bicca de Alencastro Maria Cecília B.V. de Souza Vitor F. Ferreira 《Journal of Molecular Structure》2006,778(1-3):97-103
Conformational analysis of nucleosides may have direct applications to the structure–activity relationship (SAR) studies and in the design of new drug candidates. Although conformational analysis may be accessed in many different ways, in this work it was performed using molecular dynamics (MD) simulation in order to study the dynamic behavior of a nucleoside derivative of 1,4-dihydro-4-oxoquinoline-3-carboxylic acid, synthesized by our group as a potential antiviral agent. The MD simulation was carried out during 10 ns in vacuum and in a box of water at two different temperatures (i.e., 300 and 600 K) using the AMBER force field. The in vacuum MD simulation results are in agreement with the crystallographic structure and with the DFT calculations of the nucleoside, revealing the anti conformer as the more stable one. The simulation in water, however, shows that both conformers may exist at 300 K, the temperature of the in vivo and in vitro assays, revealing that both the syn and anti conformers should be considered in a MD simulation study of the inhibitor–enzyme complex. Simulations are also in agreement with the NOE experiment, which shows that the anti conformer is the preferential one in DMSO-d6 solution at 298 K. 相似文献
6.
Densities of N, H, and NH active species have been detected by laser-induced fluorescence (LIF) in N2-xH2 dc flowing discharges. A peak value of N atom densities far x = 0.2–0.5% and a plateau value of H atom densities between x = 1% and 90% in post-discharge conditions (0.05 sec, p = 2 torr) has been found. Comparison between LIF measurements of N atoms and the trend of the N2(B, v = II) population shows that the emission from this state can be used for monitoring N atoms. The NH radical has only been detected inside the discharge region.On leave from Instituto Tecnológico de Aeronáutica, CNPq, Brazil. 相似文献
7.
The morphology of poly(methyl methacrylate), poly(ethylene oxide) blend and the grafted copolymer poly(methyl methacrylate-g-ethylene oxide) was observed by scanning electron microscopy. The contrast was obtained by an etching technique, removing the PEO phase out of the blend. The PEO phase of the copolymer was stained with OsO4 and better contrast was observed using a back-scattering image. The PEO phase was shown to be distributed as spherical domains in the PMMA matrix for both the copolymer and the blend. 相似文献
8.
9.
10.
Ferreira AR de A Vilela GV Amorim MB Perry KP da Silva AJ Dias AG Costa PR 《The Journal of organic chemistry》2004,69(12):4013-4018
The conjugate addition of benzylic phenylsulfonyl carbanions (2a'-d') to enoates derived from d-(+)-mannitol (E- or Z-1a-c) was studied using THF and THF/HMPA as solvent. Under kinetic conditions (-78 degrees C), enoate E-1a,b led to a mixture of syn-(R,S) and anti-(S,S) adducts (55/45), and syn-(R,S) adducts were the main product obtained ( approximately 90/10) from enoate Z-1a. Under thermodynamic conditions (-78 degrees C to room temperature) syn-(R,S) adducts were also preferentially formed ( approximately 90/10), despite the geometry at the double bond in the acceptor. Enoate 1c (E/Z = 57/43), bearing an additional benzyl group at the alpha-position, also reacted with carbanions 2'a,b, under thermodynamic conditions, leading to syn-adducts in excellent de (control at the three newly generated stereogenic centers). The adducts were quantitatively transformed into the corresponding beta-gamma-disubstituted gamma-butyrolactones and alpha,beta,gamma-trisubstituted gamma-butyrolactones. (1)H NMR studies (NOE and J-coupling) of these lactones allowed us to determine their configuration at the newly generated chiral centers. The reduction of the C-S bond in adducts syn-(R,S) with Na/Hg, followed by treatment of the resulting products in aqueous acid media, led to enantioenriched beta-benzyl-gamma-hydroxymethyl-gamma-butyrolactones. The conformational equilibrium of enoates E- and Z-1b was evaluated by theoretical calculations (ab initio, MP2/6-31G), and a mechanistic rationale was proposed to explain the observed stereoselectivities. 相似文献