77 research outputs found

    Bilinear Quantum Monte Carlo: Expectations and Energy Differences

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    We propose a bilinear sampling algorithm in Green's function Monte Carlo for expectation values of operators that do not commute with the Hamiltonian and for differences between eigenvalues of different Hamiltonians. The integral representations of the Schroedinger equations are transformed into two equations whose solution has the form ψa(x)t(x,y)ψb(y)\psi_a(x) t(x,y) \psi_b(y), where ψa\psi_a and ψb\psi_b are the wavefunctions for the two related systems and t(x,y)t(x,y) is a kernel chosen to couple xx and yy. The Monte Carlo process, with random walkers on the enlarged configuration space x⊗yx \otimes y, solves these equations by generating densities whose asymptotic form is the above bilinear distribution. With such a distribution, exact Monte Carlo estimators can be obtained for the expectation values of quantum operators and for energy differences. We present results of these methods applied to several test problems, including a model integral equation, and the hydrogen atom.Comment: 27 page

    Cluster Performance reconsidered: Structure, Linkages and Paths in the German Biotechnology Industry, 1996-2003

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    This paper addresses the evolution of biotechnology clusters in Germany between 1996 and 2003, paying particular attention to their respective composition in terms of venture capital, basic science institutions and biotechnology firms. Drawing upon the significance of co-location of "money and ideas", the literature stressing the importance of a cluster's openness and external linkages, and the path dependency debate, the paper aims to analyse how certain cluster characteristics correspond with its overall performance. After identifying different cluster types, we investigate their internal and external interconnectivity in comparative manner and draw on changes in cluster composition. Our results indicate that the structure, i.e. to which group the cluster belongs, and the openness towards external knowledge flows deliver merely unsystematic indications with regard to a cluster's overall success. Its ability to change composition towards a more balanced ratio of science and capital over time, on the other hand, turns out as a key explanatory factor. Hence, the dynamic perspective proves effective illuminating cluster growth and performance, where our explorative findings provide a promising avenue for further evolutionary research

    Anatomical study of the female reproductive system and bacteriome of Diaphorina citri Kuwayama, (Insecta: Hemiptera, Liviidae) using micro-computed tomography

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    Huanglongbing (HLB) (citrus greening disease) is one of the most serious bacterial diseases of citrus. It is caused by (1) Candidatus Liberibacter africanus, transmitted by Trioza erytreae and (2) C.L. asiaticus and C.L. americanus, transmitted by Diaphorina citri. As part of a multidisciplinary project on D. citri (www.citrusgreening.org), we made a detailed study, using micro-computed tomography, of the female abdominal terminalia, reproductive system (ovaries, accessory glands, spermatheca, colleterial (= cement) gland, connecting ducts, and ovipositor) and bacteriome, which we present here. New terms and structures are introduced and described, particularly concerning the spermatheca, ovipositor and bacteriome. The quality of images and bacteriome reconstructions are comparable, or clearer, than those previously published using a synchrotron or fuorescence in situ hybridisation (FISH). This study: reviews knowledge of the female reproductive system and bacteriome organ in D. citri; represents the frst detailed morphological study of D. citri to use micro-CT; and extensively revises existing morphological information relevant to psylloids, hemipterans and insects in general. High quality images and supplementary videos represent a signifcant advance in knowledge of psylloid anatomy and are useful tools for future research and as educational aids.Kansas State University (KSU) S15192.01University of Granada, USDA-NIFA S15192.01 2014-70016-2302

    In vitro Anticancer Screening of 24 Locally Used Nigerian Medicinal Plants

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    Background: Plants that are used as traditional medicine represent a relevant pool for selecting plant candidates that may have anticancer properties. In this study, the ethnomedicinal approach was used to select several medicinal plants native to Nigeria, on the basis of their local or traditional uses. The collected plants were then evaluated for cytoxicity. Methods: The antitumor activity of methanolic extracts obtained from 24 of the selected plants, were evaluated in vitro on five human cancer cell lines. Results: Results obtained from the plants screened indicate that 18 plant extracts of folk medicine exhibited promising cytotoxic activity against human carcinoma cell lines. Erythrophleum suaveolens (Guill. & Perr.) Brenan was found to demonstrate potent anti-cancer activity in this study exhibiting IC50 = 0.2-1.3 μ\mug/ml. Conclusions: Based on the significantly potent activity of some plants extracts reported here, further studies aimed at mechanism elucidation and bio-guided isolation of active anticancer compounds is currently underway.Chemistry and Chemical Biolog

    Crystal-structure of NA3(NH4)12[MO57FE6(NO)6O174(OH)3(H2O)24] · 76H2O, a Compound with an Unique Clusteranion

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    Müller A, Plass W, Krickemeyer E, et al. Kristallstruktur von Na3(NH4)12[Mo57Fe6(NO)6O174(OH)3(H2O)24] · 76H2O, einer Verbindung mit einem ungewöhnlichen Clusteranion. Monatshefte für Chemie. 1994;125(5):525-533.The X-ray crystal structure of the compound Na3(NH4)12[Mo57Fe6(NO)6O174(OH)3(H2O)24].76H2O (3) [P6(3)/mmc; a = 2380.6(5), c = 2763.497), Z = 2], the giant cluster anion of which has the shape of a doughnut, shows remarkable details: The cluster [{Fe(H2O)2}6{Mo(mu-H2O)2(mu-OH)Mo}3{Mo15(MoNO)23+O58(H2O)2}3]15-can be described as being composed of three transferable {Mo17} ligands bridged by cationic centers and contains a novel nanodimensional central cavity

    (NPr4n)[SRev(S4)(S3CMe2)]: Ein [SRev(S4)2]−-Derivat

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    Müller A, Lemke M, Krickemeyer E, Bögge H, Penk M. (NPr4n)[SRev(S4)(S3CMe2)]: Ein [SRev(S4)2]−-Derivat. Monatshefte für Chemie Chemical Monthly. 1993;124(8-9):857-866
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