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51.
A.D. Jordan Gad Fischer Katharina Rokos I.G. Ross 《Journal of Molecular Spectroscopy》1973,45(2):173-198
The following spectra have been measured at 4 K, in three polarizations: absorption of quinoxaline in durene, durene-d14, naphthalene and naphthalene-d10, and of quinoxaline-d6 in durene and naphthalene. The polarized phosphorescence of quinoxaline-d6 in durene is also recorded.The analyses permit unusually extensive assignments of excited state vibrational frequencies. Also noted are various crystal effects: isotope shifts, modification of molecular frequencies, prominence of Herzberg-Teller origins, site splittings, effects of perdeuterated hosts, and polarization ratios. An unusual line-splitting seen in durene is analyzed as a resonance between coincident a1 and b1 vibrations of the quinoxaline molecule, coupled through the exciton bands of the host. 相似文献
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We investigated the flow field in a turbulent boundary layer in a flume, by using Particle Image Velocimetry (PIV) and Hot-Foil Infrared Imaging (HFIRI) techniques. Coherent patterns in the flow were identified and characterized by using instantaneous velocity and temperature fields. The velocity fields in the streamwise–spanwise plane were measured in parallel to the temperature distribution of the flume bottom. The identified patterns are represented by means of their spatial characteristics – a non-dimensional spatial separation between streamwise patterns, +. 相似文献
54.
Rana Ahmed Youness Reem Amr Assal Shahira Mohamed Ezzat Mohamed Zakaria Gad Amira Abdel Motaal 《Natural product research》2020,34(10):1475-1480
AbstractThis study focused on studying the impact of flavonoids isolated from Cleome droserifolia on HCC cell lines and to further unveil their possible impact on TP53 and its downstream tumor suppressor miRNAs. Three flavonol glycosides were isolated from C. droserifolia namely, Isorhamnetin-3-O-β-D-glucoside (1), Quercetin-3`-methoxy-3-O-(4``-acetylrhamnoside)-7-O-α-rhamnoside (2), and Kaempferol-4`-methoxy-3,7-O-dirhamnoside (3). They showed a concentration and time dependent reduction in cellular viability and anchorage-independent growth of HCC cells. Moreover, they exhibited a decrease in the migrating capacity of HepG2 cells in a pattern similar to positive control cells. (2) Showed the most potent effects in halting HCC tumorigenic activity (IC50=36?±?1.70?µM) and a repression of the cellular proliferation rate of HepG2 cells. Restoration of TP53 and its downstream tumor suppressor miRNAs; miR-15a, miR-16, miR-34a by (2) was observed. Moreover, attenuation of (2) mediated actions was shown upon using anti-miR-15a and anti-miR-16. To conclude, this study crystallizes a novel role of C. droserifolia in harnessing HCC progression in-vitro with a possible contribution of TP53/miR-15a/miR-16. 相似文献
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56.
Xinye Liu;Fang-Fang Li;Ping Peng;Gad Licht;Stuart Licht; 《欧洲无机化学杂志》2020,2020(15-16):1428-1436
Ammonia is critical for food and chemical production; however, NH3 synthesis is one of the largest industrial greenhouse gas producers. We report a path to an exceptionally high rate (2.3 × 10–9 mol of NH3 s–1 cm–2), CO2 free NH3 electrosynthesis from H2O and air under ambient electrolysis conditions (60 °C, 1 atm). Iron oxide (dispersed in hydroxide electrolyte) catalyzed NH3 synthesis is probed at intermediate temperature (20–200 °C) and pressure (1–10 atm) with Monel mesh electrodes. Iron calcination preparation of the iron oxide catalyst is optimized by size, and then physically constrained to the reactive domain of the electrolysis cell cathode through use of mesh electrodes at even lower temperatures, allowing for an ambient, preferred electrosynthesis. These novel constraints enhance NH3 catalyst utilization at low temperature and open future pathways to the addition of ion-specific membranes to the high rate NH3 synthesis cell. 相似文献
57.
Dr. Aleya A. M. Gad 《无机化学与普通化学杂志》2012,638(6):1031-1038
Novel neutral polynuclear NiII chelates of L ‐cysteine (L ‐cyst) or D ‐penicillamine (D ‐pen) with dicyandiamide (dcda) were synthesized and characterized using elemental analysis, UV, CD, reflectance, and IR spectroscopy and/or thermogravimetric and X‐ray analysis. The obtained dinuclear compounds add important information about the chemistry of nickel(II) ions, which form types of bonds that cannot be obtained with other metal ions such as CoII. These dinuclear nickel compounds contain four‐membered rings with two sulfur and two nickel atoms. Electronic transitions were elucidated from reflectance, CD and absorbance spectroscopy and confirm a distorted square planar arrangement of the nickel ions. Because the same structure with CoII ions could not be obtained directly, dimethylglyoxime was added to a suspension of the template complex with D ‐pen in water to separate the nickel ions. The separation of the ligand was confirmed by elemental analysis, IR, and 1H NMR spectroscopy. It reacted with CoII to give a different mononuclear crystalline complex that was studied by X‐ray single crystal diffraction. The crystals are orthorhombically with space group C2221, a = 0.11769(4) pm, b = 0.13632(4) pm, c = 0.25239(8) pm, V = 0.0040490(2) pm3, and Z = 8. 相似文献
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59.
Riadh Dardouri Héla Habli Brahim Oujia Florent Xavier Gadéa 《Journal of computational chemistry》2013,34(24):2091-2099
For all states dissociating below the ionic limit Li? Rb+, we perform a diabatic study for 1Σ+ electronic states dissociating into Rb (5s, 5p, 4d, 6s, 6p, 5d, 7s, 4f) + Li (2s, 2p, 3s). Furthermore, we present the diabatic results for the 1–11 3σ, 1–8 1,3Π, and 1–4 1,3Δ states. The present calculations on the RbLi molecule are complementary to previous theoretical work on this system, including recently observed electronic states that had not been calculated previously. The calculations rely on ab‐initio pseudopotential, core polarization potential operators for the core‐valence correlation and full valence configuration interaction approaches, combined to an efficient diabatization procedure. For the low‐lying states, diabatic potentials and permanent dipole moments are analyzed, revealing the strong imprint of the ionic state in the 1Σ+ adiabatic states. The transition dipole moment is used to evaluate the radiative lifetimes of the vibrational levels trapped in the 2 1Σ+ excited states for the first time. In addition to the bound–bound contribution, the bound–free term has been evaluated using the Franck–Condon approximation and also exactly added to the total radiative lifetime. © 2013 Wiley Periodicals, Inc. 相似文献
60.
Eman A. Bakr Gad B. Al‐Hefnawy Mohamed K. Awad Hossam H. Abd‐Elatty Mohamed S. Youssef 《应用有机金属化学》2018,32(2)
The absolute necessity to fight some class of tumor is perceived as serious health concerns, so the discovery and development of effective anticancer agents are urgently needed. (E)‐4‐((2‐hydroxyphenyl)diazenyl)‐3‐phenyl‐1H‐pyrazol‐5(4H)‐one, HL, and its Ni(II), Pd(II) and Pt(II) complexes were synthesized and the biological activity was evaluated for antitumor, antioxidant and antimicrobial activity as well as DNA cleavage. Their structures were assigned depending on the elemental analysis, conductivity, magnetic moment, spectral measurements (IR, 1HNMR, mass and UV–Vis) and thermal analysis. 3D molecular modeling using DFT method confirmed that the geometrical structures agree well with the suggested experimental ones. The antitumor activity was evaluated against four different cell lines using MTT assay. The ligand HL showed a potent cytotoxic activity compared to 5‐fluorouracil as a reference drug. For metal complexes, the order of activity was: Pd(II) > Ni(II) > Pt(II). A remarkable antioxidant activity for the ligand HL was recorded. It was higher than that of the metal complexes. Results of antimicrobial experiments revealed that all compounds were moderate to highly active against selected bacterial strains but inactive as antifungal except Pd(II) which showed a moderate antifungal activity. Gel electrophoresis showed insignificant nucleases activity for the ligand or its metal complexes even in the presence of H2O2 providing protection of DNA from damage. The antitumor activity of our compounds may be not due to DNA cleavage but may be referred to a mechanism similar to that of 5‐fluorouracil which interfere with DNA replication. The present work suggests the use of this ligand in the design and development of new anticancer drugs. 相似文献