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1.
Proc Natl Acad Sci U S A ; 118(27)2021 07 06.
Article in English | MEDLINE | ID: mdl-34215694

ABSTRACT

Electron-nuclear double resonance (ENDOR) measures the hyperfine interaction of magnetic nuclei with paramagnetic centers and is hence a powerful tool for spectroscopic investigations extending from biophysics to material science. Progress in microwave technology and the recent availability of commercial electron paramagnetic resonance (EPR) spectrometers up to an electron Larmor frequency of 263 GHz now open the opportunity for a more quantitative spectral analysis. Using representative spectra of a prototype amino acid radical in a biologically relevant enzyme, the [Formula: see text] in Escherichia coli ribonucleotide reductase, we developed a statistical model for ENDOR data and conducted statistical inference on the spectra including uncertainty estimation and hypothesis testing. Our approach in conjunction with 1H/2H isotopic labeling of [Formula: see text] in the protein unambiguously established new unexpected spectral contributions. Density functional theory (DFT) calculations and ENDOR spectral simulations indicated that these features result from the beta-methylene hyperfine coupling and are caused by a distribution of molecular conformations, likely important for the biological function of this essential radical. The results demonstrate that model-based statistical analysis in combination with state-of-the-art spectroscopy accesses information hitherto beyond standard approaches.


Subject(s)
Statistics as Topic , Amino Acids/chemistry , Computer Simulation , Electron Spin Resonance Spectroscopy , Escherichia coli/enzymology , Protein Subunits/chemistry , Ribonucleotide Reductases/chemistry
2.
J Math Biol ; 78(7): 2171-2206, 2019 06.
Article in English | MEDLINE | ID: mdl-30830268

ABSTRACT

Evidence suggests that both the interaction of so-called Merkel cells and the epidermal stress distribution play an important role in the formation of fingerprint patterns during pregnancy. To model the formation of fingerprint patterns in a biologically meaningful way these patterns have to become stationary. For the creation of synthetic fingerprints it is also very desirable that rescaling the model parameters leads to rescaled distances between the stationary fingerprint ridges. Based on these observations, as well as the model introduced by Kücken and Champod we propose a new model for the formation of fingerprint patterns during pregnancy. In this anisotropic interaction model the interaction forces not only depend on the distance vector between the cells and the model parameters, but additionally on an underlying tensor field, representing a stress field. This dependence on the tensor field leads to complex, anisotropic patterns. We study the resulting stationary patterns both analytically and numerically. In particular, we show that fingerprint patterns can be modeled as stationary solutions by choosing the underlying tensor field appropriately.


Subject(s)
Algorithms , Computer Simulation , Dermatoglyphics , Epidermal Cells/cytology , Merkel Cells/cytology , Stress, Physiological , Anisotropy , Epidermal Cells/physiology , Female , Humans , Merkel Cells/physiology , Pregnancy
3.
PLoS One ; 11(5): e0154160, 2016.
Article in English | MEDLINE | ID: mdl-27171150

ABSTRACT

Fingerprint recognition plays an important role in many commercial applications and is used by millions of people every day, e.g. for unlocking mobile phones. Fingerprint image segmentation is typically the first processing step of most fingerprint algorithms and it divides an image into foreground, the region of interest, and background. Two types of error can occur during this step which both have a negative impact on the recognition performance: 'true' foreground can be labeled as background and features like minutiae can be lost, or conversely 'true' background can be misclassified as foreground and spurious features can be introduced. The contribution of this paper is threefold: firstly, we propose a novel factorized directional bandpass (FDB) segmentation method for texture extraction based on the directional Hilbert transform of a Butterworth bandpass (DHBB) filter interwoven with soft-thresholding. Secondly, we provide a manually marked ground truth segmentation for 10560 images as an evaluation benchmark. Thirdly, we conduct a systematic performance comparison between the FDB method and four of the most often cited fingerprint segmentation algorithms showing that the FDB segmentation method clearly outperforms these four widely used methods. The benchmark and the implementation of the FDB method are made publicly available.


Subject(s)
Algorithms , Dermatoglyphics , Image Interpretation, Computer-Assisted/methods , Humans
4.
PLoS One ; 10(5): e0126346, 2015.
Article in English | MEDLINE | ID: mdl-25996921

ABSTRACT

A reliable extraction of filament data from microscopic images is of high interest in the analysis of acto-myosin structures as early morphological markers in mechanically guided differentiation of human mesenchymal stem cells and the understanding of the underlying fiber arrangement processes. In this paper, we propose the filament sensor (FS), a fast and robust processing sequence which detects and records location, orientation, length, and width for each single filament of an image, and thus allows for the above described analysis. The extraction of these features has previously not been possible with existing methods. We evaluate the performance of the proposed FS in terms of accuracy and speed in comparison to three existing methods with respect to their limited output. Further, we provide a benchmark dataset of real cell images along with filaments manually marked by a human expert as well as simulated benchmark images. The FS clearly outperforms existing methods in terms of computational runtime and filament extraction accuracy. The implementation of the FS and the benchmark database are available as open source.


Subject(s)
Cytoskeleton/metabolism , Molecular Imaging/methods , Cytoskeleton/genetics , Gene Expression , Humans , Image Processing, Computer-Assisted , Mesenchymal Stem Cells/metabolism , Microscopy, Fluorescence
5.
Biom J ; 56(5): 781-5, 2014 09.
Article in English | MEDLINE | ID: mdl-24753141

ABSTRACT

This is a discussion of the following paper: "Overview of object oriented data analysis" by J. Steve Marron and Andrés M. Alonso.


Subject(s)
Data Analysis
6.
IEEE Trans Pattern Anal Mach Intell ; 32(4): 593-603, 2010 Apr.
Article in English | MEDLINE | ID: mdl-20224117

ABSTRACT

We propose an intrinsic multifactorial model for data on Riemannian manifolds that typically occur in the statistical analysis of shape. Due to the lack of a linear structure, linear models cannot be defined in general; to date only one-way MANOVA is available. For a general multifactorial model, we assume that variation not explained by the model is concentrated near elements defining the effects. By determining the asymptotic distributions of respective sample covariances under parallel transport, we show that they can be compared by standard MANOVA. Often in applications manifolds are only implicitly given as quotients, where the bottom space parallel transport can be expressed through a differential equation. For Kendall's space of planar shapes, we provide an explicit solution. We illustrate our method by an intrinsic two-way MANOVA for a set of leaf shapes. While biologists can identify genotype effects by sight, we can detect height effects that are otherwise not identifiable.


Subject(s)
Image Processing, Computer-Assisted/methods , Models, Theoretical , Multivariate Analysis , Pattern Recognition, Automated/methods , Algorithms , Biometry/methods , Normal Distribution , Plant Leaves
7.
IEEE Trans Pattern Anal Mach Intell ; 30(9): 1507-19, 2008 Sep.
Article in English | MEDLINE | ID: mdl-18617711

ABSTRACT

Quadratic differentials naturally define analytic orientation fields on planar surfaces. We propose to model orientation fields of fingerprints by specifying quadratic differentials. Models for all fingerprint classes such as arches, loops and whorls are laid out. These models are parametrised by few, geometrically interpretable parameters which are invariant under Euclidean motions. We demonstrate their ability in adapting to given, observed orientation fields, and we compare them to existing models using the fingerprint images of the NIST Special Database 4. We also illustrate that these model allow for extrapolation into unobserved regions. This goes beyond the scope of earlier models for the orientation field as those are restricted to the observed planar fingerprint region. Within the framework of quadratic differentials we are able to verify analytically Penrose's formula for the singularities on a palm. Potential applications of these models are the use of their parameters as indices of large fingerprint databases, as well as the definition of intrinsic coordinates for single fingerprint images.


Subject(s)
Artificial Intelligence , Biometry/methods , Dermatoglyphics/classification , Fingers/anatomy & histology , Image Interpretation, Computer-Assisted/methods , Models, Biological , Pattern Recognition, Automated/methods , Algorithms , Computer Simulation , Humans , Image Enhancement/methods , Reproducibility of Results , Sensitivity and Specificity , Skin/anatomy & histology
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