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2001


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A full field transmission X-ray microscope as a tool for high-resolution magnetic imaging

Denbeaux, G., Fischer, P., Kusinski, G., Le Gros, M., Pearson, A., Attwood, D.

{IEEE Transactions on Magnetics}, 37, pages: 2764-2766, 2001 (article)

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[BibTex]

2001


[BibTex]


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The six-jump diffusion cycles in B2-compounds

Drautz, R., Meyer, B., Fähnle, M.

{Defect and Diffusion Forum}, 194-199, pages: 417-422, 2001 (article)

mms

[BibTex]

[BibTex]


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Atomic defects and electronic structure of B2FeAl, CoAl and NiAl

Fähnle, M., Meyer, B., Bester, G., Majer, J., Börnsen, N.

{Defect and Diffusion Forum}, 194-199, pages: 279-285, 2001 (article)

mms

[BibTex]

[BibTex]


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Fast learning of biomimetic oculomotor control with nonparametric regression networks (in Japanese)

Shibata, T., Schaal, S.

Journal of the Robotics Society of Japan, 19(4):468-479, 2001, clmc (article)

am

[BibTex]

[BibTex]


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Bouncing a ball: Tuning into dynamic stability

Sternad, D., Duarte, M., Katsumata, H., Schaal, S.

Journal of Experimental Psychology: Human Perception and Performance, 27(5):1163-1184, 2001, clmc (article)

Abstract
Rhythmically bouncing a ball with a racket was investigated and modeled with a nonlinear map. Model analyses provided a variable defining a dynamically stable solution that obviates computationally expensive corrections. Three experiments evaluated whether dynamic stability is optimized and what perceptual support is necessary for stable behavior. Two hypotheses were tested: (a) Performance is stable if racket acceleration is negative at impact, and (b) variability is lowest at an impact acceleration between -4 and -1 m/s2. In Experiment 1 participants performed the task, eyes open or closed, bouncing a ball confined to a 1-dimensional trajectory. Experiment 2 eliminated constraints on racket and ball trajectory. Experiment 3 excluded visual or haptic information. Movements were performed with negative racket accelerations in the range of highest stability. Performance with eyes closed was more variable, leaving acceleration unaffected. With haptic information, performance was more stable than with visual information alone.

am

[BibTex]

[BibTex]


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Wing transmission for a micromechanical flying insect

Yan, J., Avadhanula, S., Birch, J., Dickinson, M., Sitti, M., Su, T., Fearing, R.

Journal of Micromechatronics, 1(3):221-237, Brill, 2001 (article)

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[BibTex]

[BibTex]


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Spontaneous L12 order at Ni90Al10(110) surfaces: An X-ray and first-principles-calculation study

Drautz, R., Reichert, H., Fähnle, M., Dosch, H., Sanchez, J. M.

{Physical Review Letters}, 87(23), 2001 (article)

mms

[BibTex]

[BibTex]


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Magnetic viscosity and demagnetization behaviour in isotropic nanocrystalline Pr12Fe82B6 ribbons

Zhang, H. W., Zhang, S. Y., Shen, B. G., Goll, D., Kronmüller, H.

{Chinese Physics}, 10(12):1169-1171, 2001 (article)

mms

[BibTex]

[BibTex]


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Strain relaxation and internal friction in the range of the glass transition

Ege, M., Ulfert, W., Kronmüller, H.

{Zeitschrift f\"ur Metallkunde}, 92(7):690-694, 2001 (article)

mms

[BibTex]

[BibTex]


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Hardness-depth profiling on nanometer scale

Kunert, M., Baretzky, B., Baker, S. P., Mittemeijer, E. J.

{Metallurgical and Materials Transactions A-Physical Metallurgy and Materials Science}, 32(5):1201-1209, 2001 (article)

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[BibTex]

[BibTex]


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Compound formation and abrasion resistance of ion-implanted Ti6Al4V

Schmidt, H., Schminke, A., Schmiedgen, M., Baretzky, B.

{Acta Materialia}, 49(3):487-495, 2001 (article)

mms

[BibTex]

[BibTex]


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Influence of vortex-vortex interaction on critical currents across low-angle grain boundaries in YBa2Cu3O7-δthin films

Albrecht, J., Leonhardt, S., Kronmüller, H.

{Physical Review B}, 63, 2001 (article)

mms

[BibTex]

[BibTex]


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Structure of superconducting [BaCuOx]2/[CaCuO2]n superlattices on SrTiO3(001) investigated by x-ray scattering

Aruta, C., Zegenhagen, J., Cowie, B., Balestrino, G., Pasquini, G., Medaglia, P. G., Ricci, F., Luebbert, D., Baumbach, T., Riedo, E., Ortega, L., Kremer, R., Albrecht, J.

{Physica Status Solidi (A)}, 183, pages: 353-364, 2001 (article)

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[BibTex]

[BibTex]


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Transmission X-ray microscopy using X-MCD

Eimüller, T., Fischer, P., Köhler, M., Scholz, M., Guttmann, P., Denbeaux, G., Glück, S., Bayreuther, G., Schmahl, G., Attwood, D., Schütz, G.

{Applied Physics A}, 73, pages: 697-701, 2001 (article)

mms

[BibTex]

[BibTex]


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Soft X-ray microscopy to 25 nm with applications to biology and magnetic materials

Denbeaux, G., Anderson, E., Chao, W., Eimüller, T., Johnson, L., Köhler, M., Larabell, C., Legros, M., Fischer, P., Pearson, A., Schütz, G., Yager, D., Attwood, D.

{Nuclear Instruments and Methods in Physics Research A}, 467-468, pages: 841-844, 2001 (article)

mms

[BibTex]

[BibTex]


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Study of in-plane magnetic domains with magnetic transmission X-ray microscopy

Fischer, P., Eimüller, T., Schütz, G., Köhler, M., Bayreuther, G., Denbeaux, G., Attwood, D.

{Journal of Applied Physics}, 89, pages: 7159-7161, 2001 (article)

mms

[BibTex]

[BibTex]


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Influence of vortex-vortex interaction on critical currents across low-angle grain boundaries in YBa2Cu3O7-δthin films

Albrecht, J., Leonhardt, S., Kronmüller, H.

{Physical Review B}, 63, 2001 (article)

mms

[BibTex]

[BibTex]


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Non-symmetric influences in the total electron yield X-ray magnetic circular dichroism signal in applied magnetic fields

Goering, E., Gold, S., Bayer, A., Schütz, G.

{Journal of Synchrotron Radiation}, 8, pages: 434-436, 2001 (article)

mms

DOI [BibTex]

DOI [BibTex]


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Effect of Ga substitution on the magnetocrystalline anisotropy of arc-melted Sm2Co17-xGax (x\textequals5,6) compounds

Liang, B., Kleinschroth, I., Kronmüller, H.

{Journal of Applied Physics}, 89(1):488-491, 2001 (article)

mms

[BibTex]

[BibTex]


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Biomimetic oculomotor control

Shibata, T., Vijayakumar, S., Conradt, J., Schaal, S.

Adaptive Behavior, 9(3/4):189-207, 2001, clmc (article)

Abstract
Oculomotor control in a humanoid robot faces similar problems as biological oculomotor systems, i.e., capturing targets accurately on a very narrow fovea, dealing with large delays in the control system, the stabilization of gaze in face of unknown perturbations of the body, selective attention, and the complexity of stereo vision. In this paper, we suggest control circuits to realize three of the most basic oculomotor behaviors and their integration - the vestibulo-ocular and optokinetic reflex (VOR-OKR) for gaze stabilization, smooth pursuit for tracking moving objects, and saccades for overt visual attention. Each of these behaviors and the mechanism for their integration was derived with inspiration from computational theories as well as behavioral and physiological data in neuroscience. Our implementations on a humanoid robot demonstrate good performance of the oculomotor behaviors, which proves to be a viable strategy to explore novel control mechanisms for humanoid robotics. Conversely, insights gained from our models have been able to directly influence views and provide new directions for computational neuroscience research.

am

link (url) [BibTex]

link (url) [BibTex]


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Irradiation-induced electron tunnelling and small-polaron hopping in single-crystalline YIG

Walz, F., Brabers, J. H. V. J., Torres, L., Kronmüller, H.

{Physica Status Solidi B-Basic Research}, 228(3):717-730, 2001 (article)

mms

[BibTex]

[BibTex]


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Hexagonally ordered 100 nm period nickel nanowire arrays

Nielsch, K., Wehrspohn, R. B., Barthel, J., Kirschner, J., Gösele, U., Fischer, S. F., Kronmüller, H.

{Applied Physics Letters}, 79(9):1360-1362, 2001 (article)

mms

[BibTex]

[BibTex]


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Magnetization processes in isotropic and textured Nd2Fe14B- films

Melsheimer, A., Kronmüller, H.

{Physica B}, 299(3-4):251-259, 2001 (article)

mms

[BibTex]

[BibTex]


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Critical magnetic properties of disordered Cr-rich FeCr alloys

Fischer, S. F., Kaul, S. N., Kronmüller, H.

{Journal of Magnetism and Magnetic Materials}, 226(Sp. Iss. SI):540-541, 2001 (article)

mms

[BibTex]

[BibTex]


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Fast ab initio methods for the calculation of adiabatic spin wave spectra in complex systems

Grotheer, O., Ederer, C., Fähnle, M.

{Physical Review B}, 63(10):100401-100401, 2001 (article)

mms

[BibTex]

[BibTex]


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Hydrogen storage in sonicated carbon materials

Hirscher, M., Becher, M., Haluska, M., Dettlaff-Weglikowska, U., Quintel, A., Duesberg, G. S., Choi, Y. M., Downes, P., Hulman, M., Roth, S., Stepanek, I., Bernier, P.

{Applied Physics A-Materials Science \& Processing}, 72(2):129-132, 2001 (article)

mms

[BibTex]

[BibTex]


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Co(NH3)2Cl2 and Co(ND3)2Cl2: Order-Disorder Behaviour of N(H,D)3 and Antiferromagnetic Structure

Leineweber, A., Jacobs, H., E\ssmann, P., Allenspach, F., Fauth, F., Fischer, P.

{Zeitschrift f\"ur Anorganische und Allgemeine Chemie}, 627, pages: 2063-2069, 2001 (article)

mms

[BibTex]

[BibTex]


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Critical magnetic properties of disordered polycrystalline Fe75Fe25 and Cr70Fe30 alloys

Fischer, S. F., Kaul, S. N., Kronmüller, H.

{Physical Review B}, 65, 2001 (article)

mms

[BibTex]

[BibTex]


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Diffusion of 23Na and 35K in the eutectic melt Na0.32K0.69

Feinauer, A., Majer, G.

{Physical Review B}, 64, 2001 (article)

mms

[BibTex]

[BibTex]


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Influence of nanocrystallization on the evolution of domain patterns and the magnetoimpedance effect in amorphous Fe73.5Cu1Nb3Si13.5B9 ribbons

Guo, H. Q., Kronmüller, H., Dragon, T., Cheng, Z. H., Shen, B. G.

{Journal of Applied Physics}, 89(1):514-520, 2001 (article)

mms

[BibTex]

[BibTex]


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Ab-initio statistical mechanics for the phase diagram of NiAl including the effect of vacancies

Lechermann, F., Fähnle, M.

{Physica Status Solidi (B)}, 224, pages: R4-R6, 2001 (article)

mms

[BibTex]

[BibTex]

1998


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Book Review: An Introduction to Fuzzy Logic for Practical Applications

Peters, J.

K{\"u}nstliche Intelligenz (KI), 98(4):60-60, November 1998 (article)

ei

[BibTex]

1998


[BibTex]


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Where did I take that snapshot? Scene-based homing by image matching

Franz, M., Schölkopf, B., Bülthoff, H.

Biological Cybernetics, 79(3):191-202, October 1998 (article)

Abstract
In homing tasks, the goal is often not marked by visible objects but must be inferred from the spatial relation to the visual cues in the surrounding scene. The exact computation of the goal direction would require knowledge about the distances to visible landmarks, information, which is not directly available to passive vision systems. However, if prior assumptions about typical distance distributions are used, a snapshot taken at the goal suffices to compute the goal direction from the current view. We show that most existing approaches to scene-based homing implicitly assume an isotropic landmark distribution. As an alternative, we propose a homing scheme that uses parameterized displacement fields. These are obtained from an approximation that incorporates prior knowledge about perspective distortions of the visual environment. A mathematical analysis proves that both approximations do not prevent the schemes from approaching the goal with arbitrary accuracy, but lead to different errors in the computed goal direction. Mobile robot experiments are used to test the theoretical predictions and to demonstrate the practical feasibility of the new approach.

ei

PDF PDF DOI [BibTex]

PDF PDF DOI [BibTex]


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On a Kernel-Based Method for Pattern Recognition, Regression, Approximation, and Operator Inversion

Smola, A., Schölkopf, B.

Algorithmica, 22(1-2):211-231, September 1998 (article)

Abstract
We present a kernel-based framework for pattern recognition, regression estimation, function approximation, and multiple operator inversion. Adopting a regularization-theoretic framework, the above are formulated as constrained optimization problems. Previous approaches such as ridge regression, support vector methods, and regularization networks are included as special cases. We show connections between the cost function and some properties up to now believed to apply to support vector machines only. For appropriately chosen cost functions, the optimal solution of all the problems described above can be found by solving a simple quadratic programming problem.

ei

PDF DOI [BibTex]


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Summarization of video-taped presentations: Automatic analysis of motion and gesture

Ju, S. X., Black, M. J., Minneman, S., Kimber, D.

IEEE Trans. on Circuits and Systems for Video Technology, 8(5):686-696, September 1998 (article)

Abstract
This paper presents an automatic system for analyzing and annotating video sequences of technical talks. Our method uses a robust motion estimation technique to detect key frames and segment the video sequence into subsequences containing a single overhead slide. The subsequences are stabilized to remove motion that occurs when the speaker adjusts their slides. Any changes remaining between frames in the stabilized sequences may be due to speaker gestures such as pointing or writing, and we use active contours to automatically track these potential gestures. Given the constrained domain, we define a simple set of actions that can be recognized based on the active contour shape and motion. The recognized actions provide an annotation of the sequence that can be used to access a condensed version of the talk from a Web page.

ps

pdf pdf from publisher DOI [BibTex]

pdf pdf from publisher DOI [BibTex]


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The moon tilt illusion

Schölkopf, B.

Perception, 27(10):1229-1232, August 1998 (article)

Abstract
Besides the familiar moon illusion [eg Hershenson, 1989 The Moon illusion (Hillsdale, NJ: Lawrence Erlbaum Associates)], wherein the moon appears bigger when it is close to the horizon, there is a less known illusion which causes the moon‘s illuminated side to appear turned away from the direction of the sun. An experiment documenting the effect is described, and a possible explanation is put forward.

ei

Web DOI [BibTex]

Web DOI [BibTex]


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Characterization of the oligomerization defects of two p53 mutants found in families with Li-Fraumeni and Li-Fraumeni-like syndrome.

Davison, T., Yin, P., Nie, E., Kay, C., CH, ..

Oncogene, 17(5):651-656, August 1998 (article)

Abstract
Recently two germline mutations in the oligomerization domain of p53 have been identified in patients with Li-Fraumeni and Li-Fraumeni-like Syndromes. We have used biophysical and biochemical methods to characterize these two mutants in order to better understand their functional defects and the role of the p53 oligomerization domain (residues 325-355) in oncogenesis. We find that residues 310-360 of the L344P mutant are monomeric, apparently unfolded and cannot interact with wild-type (WT) p53. The full length L344P protein is unable to bind sequence specifically to DNA and is therefore an inactive, but not a dominant negative mutant. R337C, on the other hand, can form dimers and tetramers, can hetero-oligomerize with WTp53 and can bind to a p53 consensus element. However, the thermal stability of R337C is much lower than that of WTp53 and at physiological temperatures more than half of this mutant is less than tetrameric. Thus, the R337C mutant retains some functional activity yet leads to a predisposition to cancer, suggesting that even partial inactivation of p53 oligomerization is sufficient for accelerated tumour progression.

ei

Web [BibTex]


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Nonlinear Component Analysis as a Kernel Eigenvalue Problem

Schölkopf, B., Smola, A., Müller, K.

Neural Computation, 10(5):1299-1319, July 1998 (article)

Abstract
A new method for performing a nonlinear form of principal component analysis is proposed. By the use of integral operator kernel functions, one can efficiently compute principal components in high-dimensional feature spaces, related to input space by some nonlinear map—for instance, the space of all possible five-pixel products in 16 × 16 images. We give the derivation of the method and present experimental results on polynomial feature extraction for pattern recognition.

ei

Web DOI [BibTex]

Web DOI [BibTex]


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SVMs — a practical consequence of learning theory

Schölkopf, B.

IEEE Intelligent Systems and their Applications, 13(4):18-21, July 1998 (article)

Abstract
My first exposure to Support Vector Machines came this spring when heard Sue Dumais present impressive results on text categorization using this analysis technique. This issue's collection of essays should help familiarize our readers with this interesting new racehorse in the Machine Learning stable. Bernhard Scholkopf, in an introductory overview, points out that a particular advantage of SVMs over other learning algorithms is that it can be analyzed theoretically using concepts from computational learning theory, and at the same time can achieve good performance when applied to real problems. Examples of these real-world applications are provided by Sue Dumais, who describes the aforementioned text-categorization problem, yielding the best results to date on the Reuters collection, and Edgar Osuna, who presents strong results on application to face detection. Our fourth author, John Platt, gives us a practical guide and a new technique for implementing the algorithm efficiently.

ei

PDF Web DOI [BibTex]

PDF Web DOI [BibTex]


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Support vector machines

Hearst, M., Dumais, S., Osman, E., Platt, J., Schölkopf, B.

IEEE Intelligent Systems and their Applications, 13(4):18-28, July 1998 (article)

Abstract
My first exposure to Support Vector Machines came this spring when heard Sue Dumais present impressive results on text categorization using this analysis technique. This issue's collection of essays should help familiarize our readers with this interesting new racehorse in the Machine Learning stable. Bernhard Scholkopf, in an introductory overview, points out that a particular advantage of SVMs over other learning algorithms is that it can be analyzed theoretically using concepts from computational learning theory, and at the same time can achieve good performance when applied to real problems. Examples of these real-world applications are provided by Sue Dumais, who describes the aforementioned text-categorization problem, yielding the best results to date on the Reuters collection, and Edgar Osuna, who presents strong results on application to face detection. Our fourth author, John Platt, gives us a practical guide and a new technique for implementing the algorithm efficiently.

ei

PDF Web DOI [BibTex]

PDF Web DOI [BibTex]


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The connection between regularization operators and support vector kernels.

Smola, A., Schölkopf, B., Müller, K.

Neural Networks, 11(4):637-649, June 1998 (article)

Abstract
n this paper a correspondence is derived between regularization operators used in regularization networks and support vector kernels. We prove that the Green‘s Functions associated with regularization operators are suitable support vector kernels with equivalent regularization properties. Moreover, the paper provides an analysis of currently used support vector kernels in the view of regularization theory and corresponding operators associated with the classes of both polynomial kernels and translation invariant kernels. The latter are also analyzed on periodical domains. As a by-product we show that a large number of radial basis functions, namely conditionally positive definite functions, may be used as support vector kernels.

ei

PDF DOI [BibTex]

PDF DOI [BibTex]


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Learning view graphs for robot navigation

Franz, M., Schölkopf, B., Mallot, H., Bülthoff, H.

Autonomous Robots, 5(1):111-125, March 1998 (article)

Abstract
We present a purely vision-based scheme for learning a topological representation of an open environment. The system represents selected places by local views of the surrounding scene, and finds traversable paths between them. The set of recorded views and their connections are combined into a graph model of the environment. To navigate between views connected in the graph, we employ a homing strategy inspired by findings of insect ethology. In robot experiments, we demonstrate that complex visual exploration and navigation tasks can thus be performed without using metric information.

ei

PDF PDF DOI [BibTex]

PDF PDF DOI [BibTex]


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Robust anisotropic diffusion

Black, M. J., Sapiro, G., Marimont, D., Heeger, D.

IEEE Transactions on Image Processing, 7(3):421-432, March 1998 (article)

Abstract
Relations between anisotropic diffusion and robust statistics are described in this paper. Specifically, we show that anisotropic diffusion can be seen as a robust estimation procedure that estimates a piecewise smooth image from a noisy input image. The edge-stopping; function in the anisotropic diffusion equation is closely related to the error norm and influence function in the robust estimation framework. This connection leads to a new edge-stopping; function based on Tukey's biweight robust estimator that preserves sharper boundaries than previous formulations and improves the automatic stopping of the diffusion. The robust statistical interpretation also provides a means for detecting the boundaries (edges) between the piecewise smooth regions in an image that has been smoothed with anisotropic diffusion. Additionally, we derive a relationship between anisotropic diffusion and regularization with line processes. Adding constraints on the spatial organization of the line processes allows us to develop new anisotropic diffusion equations that result in a qualitative improvement in the continuity of edges

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pdf pdf from publisher [BibTex]

pdf pdf from publisher [BibTex]


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No role for motion blur in either motion detection or motion based image segmentation

Wichmann, F., Henning, G.

Journal of the Optical Society of America A, 15 (2), pages: 297-306, 1998 (article)

Abstract
Determined the influence of high-spatial-frequency losses induced by motion on motion detection and on motion-based image segmentation. Motion detection and motion-based segmentation tasks were performed with either spectrally low-pass or spectrally broadband stimuli. Performance on these tasks was compared with a condition having no motion but in which form differences mimicked the perceptual loss of high spatial frequencies produced by motion. This allowed the relative salience of motion and motion-induced blur to be determined. Neither image segmentation nor motion detection was sensitive to the high-spatial-frequency content of the stimuli. Thus the change in perceptual form produced in moving stimuli is not normally used as a cue either for motion detection or for motion-based image segmentation in ordinary situations.

ei

PDF [BibTex]

PDF [BibTex]


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PET with 18fluorodeoxyglucose and hexamethylpropylene amine oxime SPECT in late whiplash syndrome

Bicik, I., Radanov, B., Schaefer, N., Dvorak, J., Blum, B., Weber, B., Burger, C., von Schulthess, G., Buck, A.

Neurology, 51, pages: 345-350, 1998 (article)

ei

[BibTex]

[BibTex]


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Changes of cerebral blood flow during short-term exposure to normobaric hypoxia

Buck, A., Schirlo, C., Jasinsky, V., Weber, B., Burger, C., von Schulthess, G., Koller, E., Pavlicek, V.

J Cereb Blood Flow Metab, 18, pages: 906-910, 1998 (article)

ei

[BibTex]

[BibTex]


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Funktionelle Magnetresonanztomographie in der psychopathologischen Forschung.

Spitzer, M., Kammer, T., Bellemann, M., Brix, G., Layer, B., Maier, S., Kischka, U., Gückel, F.

Fortschritte der Neurologie Psychiatrie, 66, pages: 241-258, 1998 (article)

Abstract
Mental disorders are characterised by psychopathological symptoms which correspond to functional brain states. Functional magnetic resonance imaging (fMRI) is used for the non-invasive study of cerebral activation patterns in man. First of all, the neurobiological principles and presuppositions of the method are outlined. Results from the Heidelberg imaging lab on several simple sensorimotor tasks as well as higher cognitive functions, such as working and semantic memory, are then presented. Thereafter, results from preliminary fMRI studies of psychopathological symptoms are discussed, with emphasis on hallucinations, psychomotoric phenomena, emotions, as well as obsessions and compulsions. Functional MRI is limited by the physics underlying the method, as well as by practical constraints regarding its use in conjunction with mentally ill patients. Within this framework, the problems of signal-to-noise ratio, data analysis strategies, motion correction, and neurovascular coupling are considered. Because of the rapid development of the field of fMRI, maps of higher cognitive functions and their respective pathology seem to be coming within easy reach.

ei

[BibTex]

[BibTex]


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Surface second-order nonlinear optical activity

Fischer, P., Buckingham, A.

JOURNAL OF THE OPTICAL SOCIETY OF AMERICA B-OPTICAL PHYSICS, 15(12):2951-2957, 1998 (article)

Abstract
Following the recent observation of a large second-harmonic intensity difference from a monolayer of chiral molecules with left and right circularly polarized light, the scattering theory is generalized and extended to predict linear and circular intensity differences for the more Versatile sum-frequency spectroscopy. Estimates indicate that intensity differences should be detectable for a typical experimental arrangement. The second-order nonlinear surface susceptibility tensor is given for different surface point groups in the electric dipole approximation; it is shown that nonlinear optical activity phenomena unambiguously probe molecular chirality only for molecular monolayers that are symmetric about the normal. Other surface symmetries can give rise to intensity differences from monolayers composed of achiral molecules. A water surface is predicted to show Linear and nonlinear optical activity in the presence of an electric field parallel to the surface. (C) 1998 Optical Society of America {[}S0740-3224(98)01311-3] OCIS codes: 190.0190, 190.4350, 240.6490.

pf

DOI [BibTex]

DOI [BibTex]


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Linear electro-optic effect in optically active liquids

Buckingham, A., Fischer, P.

CHEMICAL PHYSICS LETTERS, 297(3-4):239-246, 1998 (article)

Abstract
A linear effect of an electrostatic field F on the intensity of sum- and difference-frequency generation in a chiral liquid is predicted. It arises in the electric dipole approximation. The effect changes sign with the enantiomer and on reversing the direction of the electrostatic field. The sum-frequency generator chi(alpha beta gamma)((2)) (-omega(3);omega(1),omega(2)), where omega(3) = omega(1) + omega(2), and the electric field-induced sum-frequency generator chi(alpha beta gamma delta)((3))(-omega(3);omega(1),omega(2),0)F-delta interfere and their contributions to the scattering power can be distinguished. Encouraging predictions are given for a typical experimental arrangement. (C) 1998 Elsevier Science B.V. All rights reserved.

pf

DOI [BibTex]

DOI [BibTex]


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Monolayers of hexadecyltrimethylammonium p-tosylate at the air-water interface. 1. Sum-frequency spectroscopy

Bell, G., Li, Z., Bain, C., Fischer, P., Duffy, D.

JOURNAL OF PHYSICAL CHEMISTRY B, 102(47):9461-9472, 1998 (article)

Abstract
Sum-frequency vibrational spectroscopy has been used to determine the structure of monolayers of the cationic surfactant, hexadecyltrimethylammonium p-tosylate (C(16)TA(+)Ts(-)), at the surface of water. Selective deuteration of the cation or the anion allowed the separate detection of sum-frequency spectra of the surfactant and of counterions that are bound to the monolayer. The p-tosylate ions an oriented with their methyl groups pointing away from the aqueous subphase and with the C-2 axis tilted, on average, by 30-40 degrees from the surface normal. The vibrational spectra of C(16)TA(+) indicate that the number of gauche defects in the monolayer does not change dramatically when bromide counterions are replaced by p-tosylate. The ends of the hydrocarbon chains of C16TA+ are, however, tilted much further from the surface normal in the presence of p-tosylate than in the presence of bromide. A quantitative analysis of the sum-frequency spectra requires a knowledge of the molecular hyperpolarizability tensor: the role of ab initio calculations and Raman spectroscopy in determining the components of this tensor is discussed.

pf

DOI [BibTex]

DOI [BibTex]