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arXiv research

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.

169,051 papers · 148 categories

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36811 · May 202619922001200920182026
48 results for structure-property

Kernelized PCovR reveals structure-property relations in chemistry and materials.

problem Understanding structure-property relations in complex systems.
method Kernel Principal Covariates Regression (kernel PCovR) with sparsification.
result Kernelized PCovR effectively reveals and predicts structure-property relations.

This paper improves hierarchical community detection efficiency using local structural properties.

problem Efficiency of hierarchical community detection methods in large networks.
method Use of local structural network properties as proxies to improve efficiency.
result Achieves competitive results in modularity with improved efficiency.

Deep learning speeds up design of organic photovoltaic structures.

problem Designing optimal organic photovoltaic structures is expensive and intractable.
method Introduced a CNN architecture as a fast surrogate for structure-property mapping and used it for robust microstructural design.
result Deep learning accelerates the design process for enhancing photovoltaic device performance.

Various structural properties are developed for non-orientable surfaces in link spaces. The Möbius band tree is described to represent genus growth of one-sided surfaces in solid tori. The structure of the Tree allows various insights into the change of genus under boundary slope, which are not possible using the exist…

2011-01-13abs ↗pdf ↗

GRAND ensures node-level differential privacy for network data.

problem Lack of node-level differential privacy for network data.
method Proposes GRAND, the first mechanism for releasing networks with node-level differential privacy and preserving structural properties.
result GRAND releases networks while ensuring node-level differential privacy and preserving structural properties.

We study two global structural properties of a graph ΓΓ, denoted AS and CFS, which arise in a natural way from geometric group theory. We study these properties in the Erdös--Rényi random graph model G(n,p), proving a sharp threshold for a random graph to have the AS property asymptotically almost surely, and giving f…

2015-05-08abs ↗pdf ↗

Paper optimizes material microstructures with limited data using probabilistic methods.

problem Optimizing material properties with uncertain process-structure-property links.
method Flexible probabilistic formulation, data-driven surrogate, active learning.
result Significant improvement in accuracy with small training data.

Medial quandles are represented using a heterogeneous affine structure. As a consequence, we obtain numerous structural properties, including enumeration of isomorphism classes of medial quandles up to 13 elements.

2014-09-30abs ↗pdf ↗

Study biderivations in complete Leibniz algebras, extending Lie algebra results.

problem Defining and studying biderivations in complete Leibniz algebras.
method Analyze biderivations according to two definitions, provide conditions for biderivations, and compare symmetric and skew-symmetric biderivations.
result Necessary and sufficient conditions for biderivations in Leibniz algebras are provided.

SyNGLER generates synthetic networks efficiently while preserving key structural properties.

problem Efficiently generating realistic synthetic networks with preserved structural properties.
method SyNGLER uses latent space network models to learn and reconstruct node embeddings, then generates synthetic networks.
result SyNGLER produces synthetic networks that better preserve key network characteristics than existing approaches.

This paper has been withdrawn from arXiv.org due to a disagreement among the authors related to several peer-review comments received prior to submission on arXiv.org. Even though the current version of this paper is withdrawn, there was no disagreement between authors on the novel work in this paper. One specific issu…

2018-05-07abs ↗pdf ↗

New framework extracts useful information from tensor data with structural properties.

problem Extract useful information from tensor data with structural properties.
method Proposed an additive tensor decomposition (ATD) framework and an ADMM algorithm to solve the high dimensional optimization problem.
result Versatile and effective framework demonstrated in simulations and real medical image analysis.

A geodesic orbit manifold is a complete Riemannian manifold all of whose geodesics are orbits of one-parameter groups of isometries. We give both a geometric and an algebraic characterization of geodesic orbit manifolds that are diffeomorphic to Rn\mathbf{R}^n. Along the way, we establish various structural properties …

2018-03-02abs ↗pdf ↗

We consider the problem of minimizing the bending or elastic energy among Jordan curves confined in a given open set ΩΩ. We prove existence, regularity and some structural properties of minimizers. In particular, when ΩΩ is convex we show that a minimizer is necessarily a convex curve. We also provide an example of a…

2015-08-24abs ↗pdf ↗

Novel ML model predicts solvation free energies from atom interactions.

problem Predicting solvation free energies from atomistic interactions.
method Two encoding functions extract atomic feature vectors, interactions calculated by inner product.
result Outstanding performance and transferability on 6,493 experimental measurements.

The study examines power quotients of surface groups and mapping class groups, proving structural properties and isomorphisms.

problem Structural properties and isomorphisms of power quotients of surface groups and mapping class groups.
method Analyzes the outer automorphism and automorphism groups of power quotients, proving isomorphisms and structural properties.
result The outer automorphism group of Γ(n)Γ(n) is isomorphic to the quotient of the extended mapping class group of SS by nnth powers of Dehn twists.

Paper proposes LCP for structural encodings, outperforming existing methods.

problem Improving Graph Neural Networks performance through effective structural encodings.
method Geometric perspective, Local Curvature Profiles (LCP) for structural encodings, combining with global positional encodings, comparing with rewiring techniques.
result LCP significantly outperforms existing structural encodings and combining LCP with global positional encodings improves performance.

We propose a way of computing 4-manifold invariants, old and new, as chiral correlation functions in half-twisted 2d N=(0,2)\mathcal{N}=(0,2) theories that arise from compactification of fivebranes. Such formulation gives a new interpretation of some known statements about Seiberg-Witten invariants, such as the basic class …

2017-05-03abs ↗pdf ↗

This paper provides both a detailed study of color-dependence of link homologies, as realized in physics as certain spaces of BPS states, and a broad study of the behavior of BPS states in general. We consider how the spectrum of BPS states varies as continuous parameters of a theory are perturbed. This question can be…

2015-12-24abs ↗pdf ↗

A VAE model predicts material properties and microstructures.

problem Building forward and inverse structure-property linkages in materials science.
method Combines VAE with regression, using a two-level prior and multi-modal Gaussian mixture.
result The model achieves accurate forward and inverse predictions of material properties and microstructures.

We consider the problem of reconstructing the graph underlying an Ising model from i.i.d. samples. Over the last fifteen years this problem has been of significant interest in the statistics, machine learning, and statistical physics communities, and much of the effort has been directed towards finding algorithms with …

2014-11-22abs ↗pdf ↗

This work evaluates graph models' robustness to structural distributional shifts.

problem Evaluating graph models' robustness to structural distributional shifts.
method Proposes a general approach for inducing diverse distributional shifts based on graph structure.
result Simple models often outperform more sophisticated methods on structural distributional shifts.

Deep learning improves classification and characterization of amorphous materials.

problem Challenges in quantifying structure-property relationships and identifying structural features in amorphous materials.
method Application of convolutional neural networks and message passing neural networks to molecular dynamics simulations.
result Message passing neural networks outperform convolutional neural networks in classifying and characterizing amorphous materials.

This paper has been withdrawn by the author, as the proof of Theorem 3.2 contains a flaw; subsequently, both it and Theorem 3.3 are not known to hold. The content of Section 5 has been improved and expanded upon in two separate papers. The structural properties in 5.1 and 5.2 appear in arXiv:1101.2603; the classificati…

2007-01-31abs ↗pdf ↗

Network Embeddings (NEs) map the nodes of a given network into dd-dimensional Euclidean space Rd\mathbb{R}^d. Ideally, this mapping is such that `similar' nodes are mapped onto nearby points, such that the NE can be used for purposes such as link prediction (if `similar' means being `more likely to be connected') or c…

2018-05-19abs ↗pdf ↗

Cooperation information sharing is important to theories of human learning and has potential implications for machine learning. Prior work derived conditions for achieving optimal Cooperative Inference given strong, relatively restrictive assumptions. We relax these assumptions by demonstrating convergence for any disc…

2018-10-04abs ↗pdf ↗

Given a compact Riemannian manifold MM, we consider a warped product Mˉ=I×hM\bar M = I \times_h M where II is an open interval in $\Rr$. We suppose that the mean curvature of the fibers do not change sign. Given a positive differentiable function ψψ in Mˉ\bar M, we find a closed hypersurface ΣΣ which is solution of an e…

2008-10-18abs ↗pdf ↗