Study uses machine learning to detect pain from brain signals.
problem No validated objective measure of pain exists.
method Multi-task multiple kernel learning for personalized pain recognition.
result Supports use of fNIRS and machine learning for objective pain detection.
Bayesian optimization selects wavelengths for sugar content estimation in NIR spectroscopy.
problem Improving prediction accuracy and interpretability of spectral data for sugar content estimation.
method Formulated as a binary black-box optimization problem, proposed method uses Bayesian optimization with a sparse quadratic surrogate model and Thompson sampling.
result Improves prediction accuracy of partial least squares regression and yields more consistent wavelength regions.
This paper presents a study in task-oriented approach to stroke rehabilitation by controlling a haptic device via near-infrared spectroscopy-based brain-computer interface (BCI). The task is to command the haptic device to move in opposing directions of leftward and rightward movement. Our study consists of data acquis…
Bayesian model clusters brain activity time series.
problem Heterogeneous multivariate time series in brain imaging.
method Group-based Bayesian mixture of smoothing splines with covariate effects.
result Distinct brain activity patterns identified.
New method speeds up NIR spectroscopy calibration by 400x.
problem Efficient preprocessing selection in NIR spectroscopy.
method Operator-adaptive PLS and Ridge regression.
result Significant reduction in fitting time with comparable prediction quality.
Develops a Bayesian non-parametric approach for signal separation with varying components.
problem Signal separation with varying components across different input locations.
method Augments Gaussian Process Latent Variable Models with weighted sums of pure component signals and incorporates priors for linear weights.
result Framework allows for non-linear variations in signals and incorporates useful priors for linear weights.
Paper compares machine learning models for food authenticity.
problem Determining correct food labelling from NIR spectroscopic data.
method Applied and compared various classification, dimension reduction, and variable selection approaches to NIR datasets of meat, olive oil, and honey samples.
result Partial least squares outperformed other approaches in classifying food authenticity.
Identifying homogeneous subgroups of variables can be challenging in high dimensional data analysis with highly correlated predictors. We propose a new method called Hexagonal Operator for Regression with Shrinkage and Equality Selection, HORSES for short, that simultaneously selects positively correlated variables and…
Study generates synthetic fNIRS data and applies machine learning for improved neuroimaging.
problem Scarcity of high-quality fNIRS neuroimaging datasets.
method Synthetic data generation using Monte Carlo simulations and machine learning.
result Improved accuracy and efficiency of fNIRS tomography.
ML PCA detects phase transitions in muon spectroscopy data.
problem Detecting phase transitions in materials using muon spectroscopy data.
method Unsupervised Machine Learning (PCA) applied to asymmetry functions.
result PCA method effectively detects phase transitions in muon spectroscopy experiments.
Nuclear magnetic resonance (NMR) spectroscopy exploits the magnetic properties of atomic nuclei to discover the structure, reaction state and chemical environment of molecules. We propose a probabilistic generative model and inference procedures for NMR spectroscopy. Specifically, we use a weighted sum of trigonometric…
Brain signal variability in the measurements obtained from different subjects during different sessions significantly deteriorates the accuracy of most brain-computer interface (BCI) systems. Moreover these variabilities, also known as inter-subject or inter-session variabilities, require lengthy calibration sessions b…
Study uses evolutionary deep learning to identify galaxies obscured by star densities.
problem Identifying galaxies in the Zone of Avoidance due to high star densities and extinction.
method Evolutionary algorithm to optimize CNN architecture for near-infrared images.
result Best evolved CNN outperforms other variants in identifying galaxies in the Zone of Avoidance.
PCA improves detection of phase transitions in muon spectroscopy data from various materials.
problem Subtle changes in asymmetry function indicate phase transitions, but existing methods require material-specific knowledge.
method Applied unsupervised PCA to muon spectroscopy asymmetry data from multiple materials.
result PCA can recover phase transition indicators and improve detection of material-specific variations.
Machine learning simplifies spectroscopy equipment, making it cheaper and easier.
problem Expensive and complex spectroscopy equipment.
method Smart machine learning strategy for absorbance curve measurement.
result An extremely simplified equipment meets the needs for spectroscopy measurement.
Study optimizes Raman spectroscopy pre-processing for better model robustness.
problem Raman spectroscopy's variability hinders model robustness in biofluid analysis.
method Statistical analysis of training spectra variability to determine optimal pre-processing method.
result Improved predictive models of artificial biological fluids.
CNNs outperform standard chemometric methods for spectral data classification.
problem Reducing the need for pre-processing steps in spectral data analysis.
method Convolutional neural networks (CNNs) compared with SVMs and PLSR for classification and regression of spectral data.
result CNNs outperform standard chemometric methods, especially for classification tasks.
AI enhances cancer diagnostics using spectroscopy.
problem Early and accurate cancer diagnosis.
method Combining AI with spectroscopy-based techniques.
result AI improves cancer diagnostics speed and safety.
Automates key steps in NMR protein structure elucidation.
problem Laborious data analysis limits NMR spectroscopy potential.
method Combination of deep learning, non-parametric models, and combinatorial optimization.
result Automated detection and assignment of signals in NMR data.
Improved spectroscopy classification with deep learning and synthetic data.
problem Identifying chlorinated solvents in Raman spectra.
method Locally-connected neural network (NN) for binary classification, autoencoder-based outlier detection, and synthetic training data.
result The proposed method outperforms existing algorithms in accuracy and robustness.
This work uses neural density estimation to analyze laser-induced breakdown spectroscopy data, enabling accurate predictions and uncertainty quantification.
problem Inference of probability densities in high-dimensional spectral data is often intractable.
method Normalizing flows on structured spectral latent spaces for density estimation and uncertainty quantification.
result The approach enables generation of realistic spectral samples and accurate prediction of state vectors with well-calibrated uncertainties.
Proposes EMG mixture model for spectroscopy data.
problem Modeling residuals in spectroscopy data with positive support.
method Exponentially-modified Gaussian mixture (EMG) model with expectation-maximization algorithm.
result EMG mixture outperforms existing models in spectroscopy applications.
High-dimensional spectroscopy data makes ML models achieve near-perfect accuracy, even when chemical distinctions are absent.
problem Why machine learning models achieve near-perfect accuracy in spectroscopic classification tasks without chemically meaningful features.
method Theoretical analysis grounded in the Feldman-Hajek theorem and concentration of measure, combined with specific experiments on synthetic and real fluorescence spectra.
result Infinitesimal distributional differences in high-dimensional spaces can lead to perfect separability, making models achieve near-perfect accuracy in spectroscopy.
Proposes a method for training Bayesian neural networks using synthetic data from Raman and CARS spectra.
problem Limited real observations in Raman and CARS spectroscopy.
method Log-Gaussian Gamma Processes and Bayesian Neural Networks.
result Trained Bayesian neural networks provide accurate estimates of Raman and CARS spectra with uncertainty quantification.
Signals are generally modeled as a superposition of exponential functions in spectroscopy of chemistry, biology and medical imaging. For fast data acquisition or other inevitable reasons, however, only a small amount of samples may be acquired and thus how to recover the full signal becomes an active research topic. Bu…
Dynamic Time Warping improves regression accuracy on spectroscopy data.
problem Improving regression accuracy on spectroscopy data with DTW when data is across multiple wavelengths.
method Illustrated DTW's effectiveness on spectroscopy time-series data, showing its benefits in improving regression accuracy when only a single wavelength is considered. DTW combined with k-Nearest Neighbour reveals similarities and differences at the time-series level.
result DTW improves regression accuracy on spectroscopy data, especially when considering a single wavelength.
Paper improves gas species identification in complex mixtures using neural networks.
problem Identifying gas species in multi-gas mixtures with high accuracy.
method Multi-label neural networks with optimal thresholding for IR spectroscopy.
result Optimal thresholding improves classification performance over conventional methods.
Efficient neural network speeds up radiative transfer model processing for climate change analysis.
problem Computational inefficiency in processing spectroscopy data for climate change analysis.
method Developed an algorithm using neural networks to emulate radiative transfer models (RTMs), significantly reducing processing time.
result Multifold speedup in processing time for radiative transfer models, enabling their use with high volume imaging spectrometers.
Active learning improves neutron spectroscopy experiments by automating measurement selection.
problem Efficiently searching for signals in neutron scattering experiments with limited beam time.
method Probabilistic active learning using log-Gaussian processes.
result Automated selection of informative measurements improves experimental efficiency.
This work uses Sylvester normalizing flows for more accurate metabolite quantification in MRS.
problem Challenges in accurate metabolite quantification in MRS due to spectral overlap, low SNR, and artifacts.
method Bayesian inference framework with physics-informed Sylvester normalizing flows.
result Accurate metabolite quantification, well-calibrated uncertainties, and insights into parameter correlations and multi-modal distributions.
Optimizes tensor completion using geodesics on Segre manifolds.
problem Incomplete tensor data in recommender systems and spectroscopy.
method Riemannian conjugate gradient optimization with explicit geodesic expressions.
result Recovery of tensor decomposition from as little as 10% of data.
Deep model learns coupled representations from side information for sparse signal recovery.
problem Recovering signals from undersampled, incomplete or noisy linear measurements.
method Deep unfolding model incorporating side information from different modalities.
result Superior performance compared to single-modal and multimodal methods.
RAMANMETRIX simplifies Raman spectroscopy data analysis.
problem Complexity of Raman spectroscopy data processing.
method User-friendly software with chemometric analysis workflow.
result Facilitates integration of Raman spectroscopy into clinical routines.
Recognizing an object's material can inform a robot on the object's fragility or appropriate use. To estimate an object's material during manipulation, many prior works have explored the use of haptic sensing. In this paper, we explore a technique for robots to estimate the materials of objects using spectroscopy. We d…
High-dimensional data common in genomics, proteomics, and chemometrics often contains complicated correlation structures. Recently, partial least squares (PLS) and Sparse PLS methods have gained attention in these areas as dimension reduction techniques in the context of supervised data analysis. We introduce a framewo…
MSFA clusters high-dimensional spatial data using spline-based covariance structures.
problem Clustering high-dimensional spatial data with flexible covariance structures.
method Mixture of spatial factor analyzers with spline-based covariance and matrix variate factor analyzers for dimensionality reduction.
result Proposed models accurately infer and differentiate distinct spatial patterns in tensor-variate data.
Deep learning identifies 30 common bacterial pathogens from Raman spectra.
problem Rapid and accurate identification of pathogenic bacteria.
method State-of-the-art deep learning applied to large Raman spectroscopy dataset.
result 99.0% accuracy in identifying 30 common bacterial pathogens.
Unified method for simultaneous denoising and clustering.
problem Clustering noisy signals.
method Sparse convex wavelet clustering with fusion and group-sparse penalties.
result Unified approach that denoises and clusters simultaneously.
Logistic regression with wavelets achieves bacterial infection detection accuracy.
problem Interpreting complex biomedical signal models for high-stakes decisions.
method Wavelet features and knockoff variables for feature selection.
result Logistic regression outperforms neural networks in bacterial infection detection.
CNN identifies AGN host galaxies from Sloan Digital Sky Survey data.
problem Identifying AGN host galaxies using traditional methods is time-consuming.
method Trained a convolutional neural network on 210,000 galaxies.
result CNN can distinguish AGN host galaxies from non-active galaxies.
This study assesses the reproducibility of 1H-MRS scans across different vendors and sessions.
problem Lack of harmonization in magnetic resonance spectroscopy protocols among vendors.
method Analysis of CV and ICC for within- and between-sessions, and correlation coefficients for across machines.
result Metabolite concentrations are highly reproducible across different vendors and sessions.
The paper derives uncertainty quantification for ML models used in metrology.
problem Uncertainty quantification for ML models in metrology applications.
method Analytical expressions for mean and variance of model output are derived for various ML models.
result The derived expressions cover multiple ML models and are validated against Monte Carlo methods.
Developed AI models for multi-gas detection in near IR spectrums.
problem Detecting multiple gases in near IR spectrums.
method Used Monte Carlo KNN and multi-resolution CNN, synthesized near IR spectrums, optimized kernel sizes and channels.
result Multi-resolution CNN outperforms other models.
Deep learning improves brain tumor detection with few data.
problem Scarce training data and data corruption in medical diagnosis.
method Data distillation and augmentation to improve deep neural network training.
result Reaches human expert-level accuracy with just a few thousand training examples.
LatentNN corrects neural network attenuation bias in astronomical data.
problem Neural networks underestimate extreme values due to measurement errors.
method Jointly optimizes network parameters and latent input values.
result LatentNN reduces attenuation bias across various signal-to-noise ratios.
Novel process model for metabolomics data analysis.
problem Analyzing complex metabolomics data.
method Data-driven and hypothesis-driven data mining approaches using various techniques.
result Demonstrated applicability and strengths of MeKDDaM model.
New approach combines PCA and t-sne for better data analysis.
problem Multiscale complexity in high-dimensional data.
method Multiscale joint characterization using PCA and t-sne.
result Joint characterization detects signals not seen by PCA or t-sne alone.
A spin network is a cubic ribbon graph labeled by representations of SU(2). Spin networks are important in various areas of Mathematics (3-dimensional Quantum Topology), Physics (Angular Momentum, Classical and Quantum Gravity) and Chemistry (Atomic Spectroscopy). The evaluation of a spin network is an integ…