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991.
Protein Conformation of a Lattice Model Using Tabu Search 总被引:1,自引:0,他引:1
We apply tabu search techniques to the problem of determining the optimal configuration of a chain of protein sequences on a cubic lattice. The problem under study is difficult to solve because of the large number of possible conformations and enormous amount of computations required. Tabu search is an iterative heuristic procedure which has been shown to be a remarkably effective method for solving combinatorial optimization problems. In this paper, an algorithm is designed for the cubic lattice model using tabu search. The algorithm has been tested on a chain of 27 monomers. Computational results show that our method outperforms previously reported approaches for the same model. 相似文献
992.
I. L. Nizhnik 《Ukrainian Mathematical Journal》1998,50(11):1789-1791
We investigate a nonlinear chain of two Chua oscillators and its stable solutions.
Translated from Ukrainskii Matematicheskii Zhurnal, Vol. 50, No. 11, pp. 1567–1569, November, 1998. 相似文献
993.
V. Ya. Popkova L. E. Vinogradova L. A. Leites V. K. Osmanov 《Russian Chemical Bulletin》1991,40(10):2075-2078
The reaction of ammonia with 2-chloroperfluoro-1-cyclohexene-1-thiocyanate leads to 2-amino-7-iminoperfluoro-4,5,6-trihydrobenzo-1,3-thiazole (II) due to intramolecular heterocyclization in the Thorpe reaction with the concurrent exoiminization. Analysis of the IR spectra of (II) in CCl4 and in the solid phase indicated that molecules of (II) in the crystal form hydrogen-bonded centrosymmetric dimers (D), which are in equilibrium with free molecules of (II) in solution.Translated from Izvestiya Akademii Nauk SSSR, Seriya Khimicheskaya, No. 10, pp. 2366–2370, October, 1991.The authors express their gratitude to D. I. Zagorevskii for taking the mass spectrum of (II) and to L. S. German for a useful discussion of this work. 相似文献
994.
Keith Vaughan Ronald J. LaFrance York Tang Donald L. Hooper 《Journal of heterocyclic chemistry》1991,28(7):1709-1713
3-Alkyl-4-arylazomethylene-3,4-dihydro-1,2,3-benzotriazines 5a and 5b undergo facile 1,4-addition of methanol or ethanol to afford stable crystalline hydrazones, 6 and 8 which have been characterised by spectroscopic analysis. In particular, the nmr spectrum of 8 shows novel features due to the diastereotopic nature of the CH2 protons in the two O-ethyl groups. Compound 5b shows a property unique to the compounds in this series; refluxing this arylazomethylenetriazine in ethanol affords a rearranged product, characterised as the 1-aryl-2-cinnolinylhydrazine ( 9 ). The formation of 9 is rationalised as a ring opening-ring closure process analogous to the Dimroth rearrangement. The cinnoline 9 displays some novel chemistry arising from the facility of the arylhydrazino substituent to react with acid to give a fragmentation product, 3-methylindazole ( 7 ). 相似文献
995.
P. Schuurmans J. Wouters P. De Moor N. Severijns W. Vanderpoorten J. Vanhaverbeke L. Vanneste 《Hyperfine Interactions》1992,75(1-4):423-430
Anisotropic α-emission from nuclei in the decay chain from223Ra to207Tl has been observed using low temperature nuclear orientation in combination with high resolution α-detection at 4.2 K. Information
on partial wave amplitudes as well as hyperfine interactions has been extracted. 相似文献
996.
W. Królas A. Maj P. Bednarczyk B. Fornal W. Mceczynski J. Styczeń M. Zicebliński 《Zeitschrift für Physik A Hadrons and Nuclei》1992,344(2):145-147
High-energy gamma-rays emitted in the decay of the giant dipole resonance built on excited states of55Mn nucleus were measured with a bismuth germanate detector. Resonance parameters were extracted from the fits to the experimental spectra. Two new high-energy calibration points originating from slow-neutron capture in germanium isotopes of bismuth germanate crystal are proposed for large-volume BGO detectors. 相似文献
997.
998.
E. L. Belokoneva A. G. Ivanova S. Yu. Stefanovich O. V. Dimitrova V. S. Kurazhkovskaya 《Crystallography Reports》2004,49(4):603-613
Crystals of new rare earth borates of the composition Ln[B6O9 (OH)3] (Ln = Sm-Lu), sp. gr. R3c are synthesized under hydrothermal conditions. Their crystal structures are determined on single crystals with Ln = Ho, Gd without preliminary determination of their chemical formulas. The polar anionic framework of the crystals consists
of BO3 triangles and BO4 tetrahedra and has wide channels along the threefold axis of the structure, which are similar to the channels along the a, b, and c axes in cubic Li4[B7O12]Cl boracite with Li conductivity. Rare earth atoms are arranged in the structure over the cubic F pseudolattice, whereas
the analogous positions in Li boracites are filled with Cl anions. The squared optical nonlinearity of the new crystals is
comparable with the nonlinearity of quartz, whereas the electrical conductivity in borates at 300°C exceeds 10−6 S/cm.
__________
Translated from Kristallografiya, Vol. 49, No. 4, 2004, pp. 681–691.
Original Russian Text Copyright ? 2004 by Belokoneva, Ivanova, Stefanovich, Dimitrova, Kurazhkovskaya. 相似文献
999.
1000.