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1.
One influential parameter which mediates interactions between many types of molecules and biological membranes stems from
the lumped contributions of the transmembrane potential, dipole potential and the difference in the surface potentials on
both sides of a membrane. With relevance to cell physiology, such electrical features of a biomembrane are prone to undergoing
changes as a result of interactions with the aqueous surrounding. Among the most useful tools devoted to exploring changes
of electrical parameters of a lipid membrane induced by certain extracellular ions, lipid composition, and embedded membrane
peptides and proteins, are spectroscopic imaging and the inner field compensation (IFC) method. In this work we layout the
principles of a fully computerized version of the IFC method, which makes it more readily available to users. As a direct
application, we deployed this improved version of the IFC method to time-resolve changes induced by alamethicin monomers upon
membrane dipole potential, following their aggregation within an artificial lipid membrane. Intriguingly, even prior crossing
the membrane core, the membrane-bound alamethicin monomers are shown to significantly increase the dipole potential of the
monolayer they reside in. Such data further emphasize the yet less-explored interplay between membrane-based protein and peptides,
and the membrane dipole potential. 相似文献
2.
The rotational spectra of three low-energy conformers of thiodiglycol (TDG) (HOCH2CH2SCH2CH2OH) have been measured in a molecular beam using a pulsed-nozzle Fourier-transform microwave spectrometer. To determine the likely conformational structures with ab initio approach, conformational structures of 2-(ethylthio)ethanol (HOEES) (CH3CH2SCH2CH2OH) were used as starting points together with the consideration of possible intramolecular hydrogen bonding in TDG. Three lower-energy conformers have been found for TDG at the MP2=Full/6311G** level and ab initio results agree nicely with experimentally determined rotational constants. In addition, Stark measurements were performed for two of the three conformers for dipole moment determinations, adding to our confidence of the conformational structure matches between experimental observations and ab initio calculations. Of the three lower-energy conformers, one displays a compact folded-like structure with strong hydrogen bonding between the two hydroxyl groups and the central sulfide atom. Two other conformers have relatively open chain-like structures with hydrogen bonding between each of the hydroxyl groups to the central sulfur atom, of which one has pure b-type dipole moment according to the ab initio results. 相似文献
3.
4.
A. R. M. Castro M. M. Serna R. N. Faria N. B. Lima 《Journal of magnetism and magnetic materials》2004,280(2-3):273-280
In this study, magnetic domains in Pr16Fe76B8 sintered magnets have been observed by Kerr effect and a histogram of the angular distribution of domain orientations has been used to determine the magnetic texture (cos Φ). The degree of easy-axis alignment of Pr2Fe14B matrix grains in these magnets has been also determined by X-ray pole figure analysis using the (0 0 4) reflection. The (0 0 4) pole figure measurements were carried out by the Schultz's reflection method. The (0 0 4) normalized intensity data has been fitted for a Gaussian distribution and the degree of crystal alignment, cos Θ, has been calculated using the Stoner–Wohlfarth model. Comparison of these methods has been carried out. It has been shown that in magnets with medium and high degrees of crystallographic alignment, the pole figure values are higher than that obtained by the Kerr effect method. Conversely, in magnets with low degrees of alignment, cos Θ is lower than cos Φ. 相似文献
5.
6.
T. Al Adlouni F. Meyer C. Meyer A. Fayt 《International Journal of Infrared and Millimeter Waves》1986,7(3):405-419
The perpendicularv
8 band lying in the 1000–1100 cm–1 region has been studied from infrared and laser Stark, spectra. We were interested in the part of spectrum corresponding to the spectral range of the 9 m CO2 laser lines. Assignments of rovibrational lines with J'<40 and K'<6 have been made. About 100 Stark resonances have been assigned to 12 rovibrational transitions. Effective molecular constants and dipole moment have been determined with high accuracy. A list of close resonances with CO2 laser lines is given and may be used for optical pumping experiments. 相似文献
7.
The static dipole polarizabilities,
D
, have been studied for the ions O2–, F–, Na+, Mg2+, Cl–, K+ and Ca2+ in the crystals NaF, KF, NaCl, KC1, MgO and CaO. The starting zero-order wave functions have been generated using various exchange- and exchange-correlation potentials in order to study the effect of these potentials on
D
. The direct contribution to the dipole polarizability,
o
D
, has been determined by the uncoupled Hartree-Fock method. Self-consistency effects have been included by the geometric approximation. The crystal potential is incorporated using the Watson sphere model. Good agreement between theoretical and experimental results are found for those self-consistent potentials which exclude self-interaction. 相似文献
8.
Jonathan A. Yoffe Gerald M. Maggiora A.Terry Amos 《Theoretical chemistry accounts》1981,58(2):137-144
Stieltjes conditions and the ratio test provide necessary but not sufficient conditions onS(-2k) dipole sums. If the dipole sums are accurate the associated [n, n –1] Padé approximant provides a better representation of (), the frequency-dependent dipole polarizability, than a truncated series expression and, in addition, should bound () below. It is shown how constraints on the dipole sums effect the form of the [2,1] Padé approximant and an additional constraint is derived that ensures the analyticity of the approximant on 0 < 1. There then follows a discussion of the reliability of available literature dipole sum values for small molecules containing H, C, N and O. 相似文献
9.
A. N. Ageev A. A. Aratskova L. D. Belyakova T. N. Gvozdovich A. V. Kiselev Ya. I. Yashin J. Kàlal F. Švec 《Chromatographia》1983,17(10):545-548
Summary The retention of benzene derivatives with nonpolar and polar substituents on a porous methacrylate copolymer containing epoxy groups using both nonpolar and polar eluents was investigated. When n-hexane is used as the eluent, the retention of n-alkylbenzenes and polymethylbenzenes is weaker than that of benzene. In the case of benzene derivatives containing polar functional groups their capacity ratios (k) on this porous polymer increases approximately linearly with the increase of the adsorbate molecules dipole moment. The retention characteristics of the methacrylate copolymer were compared with that of a styrene-divinylbenzene copolymer and silica gels with a hydroxylated surface and with a surface modified by chemically bonded alkylsilyl groups. 相似文献
10.
Wiosetek-Reske AM Wysocki S Bak GW 《Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy》2005,62(4-5):1172-1178
The absorption and fluorescence spectra of N-nonyl acridine orange are determined at room temperature (298 K) in cyclohexane, benzene, carbon tetrachloride, chloroform, chlorobenzene and dichloromethane. The ground state of dipole moment was obtained by impedance measurements using Guggenheim-Debeye's method. The experimental excited state dipole moment of N-nonyl acridine orange was determined using Bakhshiev's and Kawski-Chamma-Viallet's formulae and solvent polarity parameter proposed by Reichardt. These experimental results were completed with theoretical results using quantum chemical methods. The experimental (muexp=10.76 D) and theoretical (mucal=9.9 D) dipole moments in the ground and excited state (muexp*=14.56 D) were compared. 相似文献