A locally-built, LLM-digested index of recent arXiv papers in quant finance, geometry/topology, and statistical ML — keyword search served straight from SQLite on this machine.
Persistent homology provides a new, efficient molecular descriptor for protein dynamics.
The ability to visually re-identify objects is a fundamental capability in vision systems. Oftentimes, it relies on collections of visual signatures based on descriptors, such as SIFT or SURF. However, these traditional descriptors were designed for a certain domain of surface appearances and geometries (limited relief…
Gryffin optimizes categorical variables in materials design, leveraging expert knowledge.
Framework for interpreting ML models to reveal properties of real-world phenomena.
In this paper, a new descriptor selection method for selecting an optimal combination of important descriptors of sulfonamide derivatives data, named self tuned reweighted sampling (STRS), is developed. descriptors are defined as the descriptors with large absolute coefficients in a multivariate linear regression model…
A new method learns from multi-modal sequences with external memory.
A new model designs molecular latent vectors for drug discovery.
The existing automatic fingerprint verification methods are designed to work under the assumption that the same sensor is installed for enrollment and authentication (regular matching). There is a remarkable decrease in efficiency when one type of contact-based sensor is employed for enrolment and another type of conta…
We tackle the problem of unsupervised visual descriptors compression, which is a key ingredient of large-scale image retrieval systems. While the deep learning machinery has benefited literally all computer vision pipelines, the existing state-of-the-art compression methods employ shallow architectures, and we aim to c…
We present a technique for efficiently synthesizing images of atmospheric clouds using a combination of Monte Carlo integration and neural networks. The intricacies of Lorenz-Mie scattering and the high albedo of cloud-forming aerosols make rendering of clouds---e.g. the characteristic silverlining and the "whiteness" …
Optimizes atomic descriptors to reduce redundancy and improve machine learning models.
This work characterizes topological descriptors of graph products and their expressive power.
A framework separates chemical and structural contributions to aqueous solubility.
This paper presents a novel approach to exploit the distinctive invariant features in convolutional neural network. The proposed CNN model uses Scale Invariant Feature Transform (SIFT) descriptor instead of the max-pooling layer. Max-pooling layer discards the pose, i.e., translational and rotational relationship betwe…
Informative and discriminative feature descriptors play a fundamental role in deformable shape analysis. For example, they have been successfully employed in correspondence, registration, and retrieval tasks. In the recent years, significant attention has been devoted to descriptors obtained from the spectral decomposi…
Although the recent progress in the deep neural network has led to the development of learnable local feature descriptors, there is no explicit answer for estimation of the necessary size of a neural network. Specifically, the local feature is represented in a low dimensional space, so the neural network should have mo…
ALP outperforms other data descriptors in one-class classification.
We introduce a new learned descriptor for audio signals which is efficient for event representation. The entries of the descriptor are produced by evaluating a set of regressors on the input signal. The regressors are class-specific and trained using the random regression forests framework. Given an input signal, each …
Wittgenstein's Rule Following evolves datasets by extrapolating structural descriptors.
Quantitative structure-activity relationship (QSAR) modelling is effective 'bridge' to search the reliable relationship related bioactivity to molecular structure. A QSAR classification model contains a lager number of redundant, noisy and irrelevant descriptors. To address this problem, various of methods have been pr…
In modern building infrastructures, the chance to devise adaptive and unsupervised data-driven health monitoring systems is gaining in popularity due to the large availability of big data from low-cost sensors with communication capabilities and advanced modeling tools such as Deep Learning. The main purpose of this pa…
Support Vector Machines (SVMs) are powerful learners that have led to state-of-the-art results in various computer vision problems. SVMs suffer from various drawbacks in terms of selecting the right kernel, which depends on the image descriptors, as well as computational and memory efficiency. This paper introduces a n…
PolyGraph Discrepancy improves graph generative model evaluation.
Counting and classifying blood cells is an important diagnostic tool in medicine. Support Vector Machines are increasingly popular and efficient and could replace artificial neural network systems. Here a method to classify blood cells is proposed using SVM. A set of statistics on images are implemented in C++. The MPE…
Method separates target signal properties from noisy mixtures.
Machine learning predicts molecular crystal stability.
In conventional chemisorption model, the d-band center theory (augmented sometimes with the upper edge of d-band for imporved accuarcy) plays a central role in predicting adsorption energies and catalytic activity as a function of d-band center of the solid surfaces, but it requires density functional calculations that…
Combines curvature descriptors with TDA for graph model evaluation.
Framework separates chemical and structural contributions to aqueous solubility.
Paper introduces stable vectorization for multiparameter PH using signed barcodes.
Manipulating video content is easier than ever. Due to the misuse potential of manipulated content, multiple detection techniques that analyze the pixel data from the videos have been proposed. However, clever manipulators should also carefully forge the metadata and auxiliary header information, which is harder to do …
DRAGON improves learning for rare classes in unbalanced datasets using class descriptions.
The article uses PageRank and persistent homology for scalable graph comparison.
Covariance and histogram image descriptors provide an effective way to capture information about images. Both excel when used in combination with special purpose distance metrics. For covariance descriptors these metrics measure the distance along the non-Euclidean Riemannian manifold of symmetric positive definite mat…
New method enhances graph neural networks using contractions and hourglass persistence.
With the increased need for multi-center magnetic resonance imaging studies, problems arise related to differences in hardware and software between centers. Namely, current algorithms for brain volume quantification are unreliable for the longitudinal assessment of volume changes in this type of setting. Currently most…
Tiled Squeeze-and-Excite improves channel attention with local spatial context.
Time series forecasting models fail to consistently select the best model across different datasets.
Method embeds numeric tabular datasets into a shared vector space for similarity and retrieval.
In this paper, we provide a new neural-network based perspective on multi-task learning (MTL) and multi-domain learning (MDL). By introducing the concept of a semantic descriptor, this framework unifies MDL and MTL as well as encompassing various classic and recent MTL/MDL algorithms by interpreting them as different w…
New method uses geometric moments for accurate machine learning potentials.
Survey on optimizing topological descriptors for machine learning.
We introduce weighted atom-centered symmetry functions (wACSFs) as descriptors of a chemical system's geometry for use in the prediction of chemical properties such as enthalpies or potential energies via machine learning. The wACSFs are based on conventional atom-centered symmetry functions (ACSFs) but overcome the un…
Unsupervised feature learning has shown impressive results for a wide range of input modalities, in particular for object classification tasks in computer vision. Using a large amount of unlabeled data, unsupervised feature learning methods are utilized to construct high-level representations that are discriminative en…
This paper studies the cooperative training of two generative models for image modeling and synthesis. Both models are parametrized by convolutional neural networks (ConvNets). The first model is a deep energy-based model, whose energy function is defined by a bottom-up ConvNet, which maps the observed image to the ene…
Explanations in Machine Learning come in many forms, but a consensus regarding their desired properties is yet to emerge. In this paper we introduce a taxonomy and a set of descriptors that can be used to characterise and systematically assess explainable systems along five key dimensions: functional, operational, usab…
Bayesian-guided method selects optimal design from large candidate pool.
We use persistent homology along with the eigenfunctions of the Laplacian to study similarity amongst triangulated 2-manifolds. Our method relies on studying the lower-star filtration induced by the eigenfunctions of the Laplacian. This gives us a shape descriptor that inherits the rich information encoded in the eigen…