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Joachim M Buhmann

Publications and source records attributed to Joachim M Buhmann.

4 recordsLinked to original sources

Semi-supervised LC/MS alignment for differential proteomics.

MOTIVATION: Mass spectrometry (MS) combined with high-performance liquid chromatography (LC) has received considerable attention for high-throughput analysis of proteomes. Isotopic labeling techniques such as ICAT [5,6] have been successfully applied to derive differential quantitative information for two protein samples, however at the price of significantly increased complexity of the experimental setup. To overcome these limitations, we consider a label-free setting where correspondences between elements of two samples have to be established prior to the comparative analysis. The alignment between samples is achieved by nonlinear robust ridge regression. The correspondence estimates are guided in a semi-supervised fashion by prior information which is derived from sequenced tandem mass spectra. RESULTS: The semi-supervised method for finding correspondences was successfully applied to aligning highly complex protein samples, even if they exhibit large variations due to different biological conditions. A large-scale experiment clearly demonstrates that the proposed method bridges the gap between statistical data analysis and label-free quantitative differential proteomics. AVAILABILITY: The software will be available on the website http://people.inf.ethz.ch/befische/proteomics.

Algorithms↗

NovoHMM: a hidden Markov model for de novo peptide sequencing.

De novo sequencing of peptides poses one of the most challenging tasks in data analysis for proteome research. In this paper, a generative hidden Markov model (HMM) of mass spectra for de novo peptide sequencing which constitutes a novel view on how to solve this problem in a Bayesian framework is proposed. Further extensions of the model structure to a graphical model and a factorial HMM to substantially improve the peptide identification results are demonstrated. Inference with the graphical model for de novo peptide sequencing estimates posterior probabilities for amino acids rather than scores for single symbols in the sequence. Our model outperforms state-of-the-art methods for de novo peptide sequencing on a large test set of spectra.

Amino Acid Sequence↗

Image segmentation by networks of spiking neurons.

A network of leaky integrate-and-fire (IAF) neurons is proposed to segment gray-scale images. The network architecture with local competition between neurons that encode segment assignments of image blocks is motivated by a histogram clustering approach to image segmentation. Lateral excitatory connections between neighboring image sites yield a local smoothing of segments. The mean firing rate of class membership neurons encodes the image segmentation. A weight modification scheme is proposed that estimates segment-specific prototypical histograms. The robustness properties of the network implementation make it amenable to an analog VLSI realization. Results on synthetic and real-world images demonstrate the effectiveness of the architecture.

Action Potentials↗

Stability-based validation of clustering solutions.

Data clustering describes a set of frequently employed techniques in exploratory data analysis to extract "natural" group structure in data. Such groupings need to be validated to separate the signal in the data from spurious structure. In this context, finding an appropriate number of clusters is a particularly important model selection question. We introduce a measure of cluster stability to assess the validity of a cluster model. This stability measure quantifies the reproducibility of clustering solutions on a second sample, and it can be interpreted as a classification risk with regard to class labels produced by a clustering algorithm. The preferred number of clusters is determined by minimizing this classification risk as a function of the number of clusters. Convincing results are achieved on simulated as well as gene expression data sets. Comparisons to other methods demonstrate the competitive performance of our method and its suitability as a general validation tool for clustering solutions in real-world problems.

Algorithms↗