Images captured by different sensors with different spectral bands cause non-linear intensity changes between image pairs. Classic feature descriptors cannot handle this problem and are prone to yielding unsatisfactory results. Inspired by the illumination and contrast invariant properties of phase congruency, here, we propose a new descriptor to tackle this problem. The proposed descriptor generation mainly involves three steps. (1) Images are convolved with a bank of log-Gabor filters with different scales and orientations. (2) A window of fixed size is selected and divided into several blocks for each keypoint, and an oriented magnitude histogram and the orientation of the minimum moment of a phase congruency-based histogram are calculated in each block. (3) These two histograms are normalized respectively and concatenated to form the proposed descriptor. Performance evaluation experiments on three datasets were carried out to validate the superiority of the proposed method. Experimental results indicated that the proposed descriptor outperformed most of the classic and state-of-art descriptors in terms of precision and recall within an acceptable computational time.
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http://dx.doi.org/10.3390/s20185105 | DOI Listing |
J Chem Theory Comput
January 2025
State Key Laboratory of Molecular Reaction Dynamics, Dalian Institute of Chemical Physics, Chinese Academy of Science, Dalian 116023, People's Republic of China.
Symmetric functions, such as Permutationally Invariant Polynomials (PIPs) and Fundamental Invariants (FIs), are effective and concise descriptors for incorporating permutation symmetry into neural network (NN) potential energy surface (PES) fitting. The traditional algorithm for generating such symmetric polynomials has a factorial time complexity of , where is the number of identical atoms, posing a significant challenge to applying symmetric polynomials as descriptors of NN PESs for larger systems, particularly with more than 10 atoms. Herein, we report a new algorithm which has only linear time complexity for identical atoms.
View Article and Find Full Text PDFPhys Chem Chem Phys
January 2025
School of Chemistry and Chemical Engineering, Guangzhou University, Guangzhou 510006, P. R. China.
Electrocatalytic oxidation of 5-hydroxymethylfurfural (HMF) to 2,5-furandicarboxylic acid (FDCA) is a promising alternative for oxygen evolution reactions. The search for efficient catalysts has been attracting increasing scientific attention. This work explores the performance of nitrogen-doped graphene-supported single-atom catalysts (M-NC SACs) for the reaction.
View Article and Find Full Text PDFJ Phys Chem C Nanomater Interfaces
January 2025
Center for Materials Science and Nanotechnology (SMN), Department of Chemistry, University of Oslo, P.O. Box 1033, Blindern, Oslo N-0315, Norway.
The flexibility of the H-ZSM-5 zeolite upon adsorption of selected coke precursors was investigated using both theoretical and experimental approaches. Four structural models with varying active site locations were analyzed through density functional theory (DFT) simulations to determine their responses to different types and quantities of aromatic molecules. Complementary experimental analysis was performed, allowing for a direct comparison with the theoretical findings, using thermogravimetric analysis (TGA), nitrogen adsorption (N adsorption), solid-state NMR, and X-ray diffraction (XRD).
View Article and Find Full Text PDFChemphyschem
January 2025
University of North Carolina, Research Computing Center, 211 Manning Drive, 27599-3420, Chapel Hill, UNITED STATES OF AMERICA.
Covalent bonding and noncovalent interactions are important chemical concepts and how to identify them has been of current interest in the literature. Within the framework of density functional theory (DFT), we recently proposed a few qualitative descriptors to categorize different types of interactions with Pauli energy and its derivatives. In this work, we expand the scope by including the quantities derived from energetic information, which were recently proposed and thoroughly investigated by us from the framework of information-theoretic approach (ITA) in DFT.
View Article and Find Full Text PDFFront Oncol
January 2025
Department of Radiation Oncology, Yonsei Cancer Center, Heavy Ion Therapy Research Institute, Yonsei University College of Medicine, Seoul, Republic of Korea.
Purpose: Recent deep-learning based synthetic computed tomography (sCT) generation using magnetic resonance (MR) images have shown promising results. However, generating sCT for the abdominal region poses challenges due to the patient motion, including respiration and peristalsis. To address these challenges, this study investigated an unsupervised learning approach using a transformer-based cycle-GAN with structure-preserving loss for abdominal cancer patients.
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