全文获取类型
收费全文 | 5186篇 |
免费 | 249篇 |
国内免费 | 52篇 |
专业分类
化学 | 3601篇 |
晶体学 | 54篇 |
力学 | 251篇 |
综合类 | 1篇 |
数学 | 605篇 |
物理学 | 975篇 |
出版年
2023年 | 43篇 |
2022年 | 126篇 |
2021年 | 322篇 |
2020年 | 239篇 |
2019年 | 239篇 |
2018年 | 206篇 |
2017年 | 168篇 |
2016年 | 274篇 |
2015年 | 152篇 |
2014年 | 208篇 |
2013年 | 454篇 |
2012年 | 324篇 |
2011年 | 323篇 |
2010年 | 202篇 |
2009年 | 173篇 |
2008年 | 217篇 |
2007年 | 227篇 |
2006年 | 184篇 |
2005年 | 138篇 |
2004年 | 143篇 |
2003年 | 123篇 |
2002年 | 139篇 |
2001年 | 63篇 |
2000年 | 45篇 |
1999年 | 39篇 |
1998年 | 35篇 |
1997年 | 25篇 |
1996年 | 36篇 |
1995年 | 34篇 |
1994年 | 33篇 |
1993年 | 27篇 |
1992年 | 32篇 |
1991年 | 36篇 |
1990年 | 25篇 |
1989年 | 45篇 |
1988年 | 37篇 |
1987年 | 28篇 |
1986年 | 31篇 |
1985年 | 28篇 |
1984年 | 35篇 |
1983年 | 26篇 |
1982年 | 18篇 |
1981年 | 20篇 |
1980年 | 22篇 |
1979年 | 18篇 |
1978年 | 23篇 |
1977年 | 18篇 |
1976年 | 14篇 |
1974年 | 11篇 |
1973年 | 11篇 |
排序方式: 共有5487条查询结果,搜索用时 31 毫秒
151.
Hanifa Daoui Yasmine Bouhamidi Ahmed Boucherit Mohamed Zouikri 《International Journal of Polymer Analysis and Characterization》2018,23(5):463-473
The fundamental understanding of the behavior of a solid is intimately related to the understanding of the interactions on the surface of the latter, a major challenge in particular if the material is natural and ecological. The infinite dilution-inverse gas chromatography was used to evaluate the surface thermodynamic properties of several phases (grafted and/or coated) diatomite. A series of non- or polar-solute probes were injected at temperatures of 45?°C and 90?°C. The dispersive surface free energies values of the supports decrease with increasing temperature and their active surface is amphoteric with predominantly acidic character. 相似文献
152.
Coordination compounds of Fe(III), Zn(II), Ni(II), Co(II), Cu(II), Cd(II) and Mn(II) ions were synthesized from the ligand [4,4′‐((((ethane‐1,2‐diylbis(oxy))bis(2,1‐phenylene))bis(methanylylidene))bis(azanylylidene))diphenol]ethane (H2L) derived from the condensation of bisaldehyde and 4‐aminophenol. Microanalysis, magnetic susceptibility, infrared, 1H NMR and mass spectroscopies, molar conductance, X ray powder diffraction and thermal analysis were used to confirm the structure of the synthesized chelates. According to the data obtained, the composition of the 1:1 metal ion–bis‐Schiff base ligand was found to be [M(H2L)(H2O)2]Cln (M = Zn(II), Ni(II), Co(II), Cu(II), Cd(II) and Mn(II), n = 2; Fe(III), n = 3). Magnetic susceptibility measurements and reflectance spectra suggested an octahedral geometry for the complexes. Central metals ions and bis‐Schiff base coordinated together via O2 and N2 donor sites which as evident from infrared spectra. The Gaussian09 program was applied to optimize the structural formula for the investigated Schiff base ligand. The energy gaps and other important theoretical parameters were calculated applying the DFT/B3LYP method. Molecular docking using AutoDock tools was utilized to explain the experimental behaviour of the Schiff base ligand towards proteins of Bacillus subtilis (5 h67), Escherichia coli (3 t88), Proteus vulgaris (5i39) and Staphylococcus aureus (3ty7) microorganisms through theoretical calculations. The docked protein receptors were investigated and the energies of hydrogen bonding were calculated. These complexes were then subjected to in vitro antibacterial studies against several organisms, both Gram negative (P. vulgaris and E. coli) and Gram positive (S. pyogones and B. subtilis). The ligand and metal complexes exhibited good microbial activity against the Gram‐positive and Gram‐negative bacteria. 相似文献
153.
Ahmed Ghoniem Agha Iqbal Ali Mohammed Al-Salem Wael Khallouli 《The Journal of the Operational Research Society》2017,68(10):1183-1194
The FIFA World Cup, comprising sixty-four matches spanning an entire month, has, in recent years, been attended by about three million spectators of which over half a million are visitors requiring lodging. Planning lodging capacity for an event of this magnitude is necessary for host nations where pre-existing infrastructures are either inadequate or lacking. This paper develops an optimization analytics framework that sequentially employs two integer programming models for foreign spectator analysis and the consequent lodging requirements. The framework is applied to assess the preparedness of lodging infrastructure in Qatar for FIFA 2022. 相似文献
154.
An evaluation of the CYP2D6 and CYP3A4 inhibition potential of metoprolol metabolites and their contribution to drug–drug and drug–herb interaction by LC‐ESI/MS/MS 下载免费PDF全文
Roshan M. Borkar Murali Mohan Bhandi Ajay P. Dubey V. Ganga Reddy Prashanth Komirishetty Prajwal P. Nandekar Abhay T. Sangamwar Ahmed Kamal Sanjay K. Banerjee R. Srinivas 《Biomedical chromatography : BMC》2016,30(10):1556-1572
The aim of the present study was to evaluate the contribution of metabolites to drug–drug interaction and drug–herb interaction using the inhibition of CYP2D6 and CYP3A4 by metoprolol (MET) and its metabolites. The peak concentrations of unbound plasma concentration of MET, α‐hydroxy metoprolol (HM), O‐desmethyl metoprolol (ODM) and N‐desisopropyl metoprolol (DIM) were 90.37 ± 2.69, 33.32 ± 1.92, 16.93 ± 1.70 and 7.96 ± 0.94 ng/mL, respectively. The metabolites identified, HM and ODM, had a ratio of metabolic area under the concentration–time curve (AUC) to parent AUC of ≥0.25 when either total or unbound concentration of metabolite was considered. In vitro CYP2D6 and CYP3A4 inhibition by MET, HM and ODM study revealed that MET, HM and ODM were not inhibitors of CYP3A4‐catalyzed midazolam metabolism and CYP2D6‐catalyzed dextromethorphan metabolism. However, DIM only met the criteria of >10% of the total drug related material and <25% of the parent using unbound concentrations. If CYP inhibition testing is solely based on metabolite exposure, DIM metabolite would probably not be considered. However, the present study has demonstrated that DIM contributes significantly to in vitro drug–drug interaction. Copyright © 2016 John Wiley & Sons, Ltd. 相似文献
155.
The structural, electronic, and optical properties of Zn_3(VO_4)_2 are investigated using full potential linearized augmented plane wave(FP-LAPW) method within the framework of density functional theory(DFT). Various approaches are adopted to treat the exchange and correlation potential energy such as generalized gradient approximation(GGA),GGA+U, and the Tran–Blaha modified Becke–Johnson(TB-mBJ) potential. The calculated band gap of 3.424 eV by TB-mBJ is found to be close to the experimental result(3.3 eV). The optical anisotropy is analyzed through optical constants,such as dielectric function and absorption coefficient along parallel and perpendicular crystal orientations. The absorption coefficient reveals high absorption(1.5 × 10~(6) cm~(-1)) of photons in the ultraviolet region. 相似文献
156.
Nageh K. Allam Ahmed Abdel Nazeer Elsayed A. Ashour 《Journal of Solid State Electrochemistry》2012,16(1):353-360
One of the major challenges in material design is the achievement of reasonable operational efficiency through understanding
the factors affecting the material’s performance particularly strength and service lifetime characteristics. In this work,
the electrochemical behavior of 72Cu–28Zn α-brass alloy in Na2MoO4-containing electrolytes was investigated using potentiodynamic polarization and electrochemical frequency modulation techniques
complemented with scanning electron microscopy. Also, stress corrosion cracking behavior of the alloy under both open-circuit
potential and anodic applied potentials, using the slow strain rate technique, was evaluated. The results drawn from the different
techniques are comparable. 相似文献
157.
Abdellatif Kamal El Bouâzzaoui Choubabi Ahmed Jellal 《The European Physical Journal B - Condensed Matter and Complex Systems》2018,91(5):91
We study the electronic band structures of massless Dirac fermions in symmetrical graphene superlattice with cells of three regions. opening gaps and additional Dirac points. Finally, we inspect the potential effect on minibands, the anisotropy of group velocity and the energy bands contours near Dirac points. We also discuss the evolution of gap edges and cutoff region near the vertical Dirac points. 相似文献
158.
Adel Z. El‐Sonbati Mostafa A. Diab Ahmed M. Eldesoky Shaimaa M. Morgan Omnia L. Salem 《应用有机金属化学》2019,33(5)
Novel polymer complexes of 8‐hydroxyquinoline‐5‐sulfonic acid hydrate ( H 2 L ) with Cu2+, Co2+ and Ni2+ chloride were prepared and characterized. Microanalysis, magnetic susceptibility, IR spectra, electron spin resonance, mass spectra, X‐ray, molar conductance, thermal, and UV–Vis spectra studies have been used to confirm the structure of the prepared polymer complexes. The molecular and electronic structures of the hydrogen bond conformers for ligand ( H 2 L ) were optimized theoretically and the quantum chemical parameters were calculated. On the basis of elemental and IR data, the chemical structure of metal chelates commensurate that the tri‐dentate (H2L) coordinate to metal chlorides through oxygen atom of phenolic OH and oxygen atom of SO3‐H group by replacing H atoms and nitrogen of the quinoline ring. The magnetic studies suggested the octahedral geometrical structure for all produced polymer complexes with general formula {[ML (OH2)3] .xH2O}n (M = Cu2+, x = 1.; Co2+, x = 2 and Ni2+, x = 2) in molar ratio (1:1). Coats–Redfern and Horowitz–Metzger methods have been used for calculating the activation thermodynamic parameters of the thermal decomposition for H 2 L and its polymer complexes. The interaction between H 2 L and its transition metal complexes with the calf thymus DNA (CT‐DNA) was determined by UV–Vis spectra. Binding efficiency between H 2 L with the receptors of the prostate cancer (PDB code 2Q7L Hormone) and the breast cancer (PDB code 1JNX Gene regulation) was studied by molecular docking. The inhibition behaviour of H 2 L against the corrosion of carbon steel / HCl (2 M) solution was studied by weight loss, Tafel polarisation, electrochemical impedance spectroscopy (EIS) and electrochemical frequency modulation (EFM) techniques. The adsorption isotherm was found to be Friendlish isotherm. The morphology of inhibited carbon steel? s surface was studied using scanning electron microscope (SEM) and energy dispersive X‐ray spectroscopy (EDS). 相似文献
159.
Abd-Rabbou M. Y. Khalil E. M. Ahmed M. M. A. Obada A.-S. F. 《International Journal of Theoretical Physics》2019,58(12):4012-4024
International Journal of Theoretical Physics - The interaction between a moving two-level atom and squeezed coherent states in the presence of Kerr like medium and an external classical field is... 相似文献
160.
New carbohydrazone ligand derived from the condensation of carbohydrazide and ethyl acetoacetate, diethyl 3,3′‐(carbonylbis (hydrazin‐2‐yl‐1‐ylidene))(3E,3′E)‐dibutyrate (H4EBC), and its divalent Co, Ni and Cu chelates have been isolated and characterized utilizing convenient methods. 1H‐NMR spectrum of H4EBC revealed the abundance of the enol isomer in solution, which was the opposite to what was shown by the solid IR. This was supported by comparing the theoretical IR of both keto and enol forms. In [Ni(H4EBC)Cl2(H2O)]·2H2O, H4EBC acts as a neutral NON tridentate ligand via the (C=O)carbonyl oxygen atom besides the two (C=N)azomethine nitrogen atoms, while in [Co(H4EBC)Cl2(2H2O)]·2H2O, H4EBC behaves as a neutral NN bidentate ligand through the two azomethine groups. Magnetic measurements inherent to their electronic spectra show that both Ni (II) and Co (II) chelates have octahedron coordination frameworks. On the other hand, the ligand behaves as a binegative tetradentate in [Cu2(H4EBC)Cl2]·H2O via the deprotonated (C=O)carbonyl groups of the ethyl acetoacetate framework and the two (C=N)azomethine groups. In the latter complex, the carbonyl group of the carbohydrazide moiety is converted to hydroxyl group. Cu (II) complex has a tetrahedral geometry according to ESR and electronic spectral data. The reaction of H4EBC with SmCl3·6H2O or LnCl3·7H2O gave single crystals of abnormal product (C16H16N4O4). The packing diagram of this crystal has a chain structure. The photoluminescence spectra of [Cu 2 (H 4 EBC)Cl 2 ]·H 2 O , [Co(H 4 EBC)Cl 2 (H 2 O) 2 ]·2H 2 O and [Ni(H 4 EBC)Cl 2 (H 2 O)]·2H 2 O display emission broad‐bands at 342, 321 and 337 nm, respectively. The microbial behavior of the synthesized moieties was investigated against various bacterial and fungal strains. [Cu2(H4EBC)Cl2]·H2O complex shows the same activity as ampicillin towards Escherichia coli and Staphylococcus aureus with inhibition zones of 26 and 22 mm, respectively. Antioxidant activity is determined using bleomycin‐dependent DNA damage assay besides erythrocyte hemolysis. Finally, in vitro cytotoxic activities against two different cell lines have been examined. 相似文献