Bi-stochastically normalized graph Laplacian: convergence to manifold Laplacian and robustness to outlier noise. [PDF]
Cheng X, Landa B.
europepmc +1 more source
PCA via joint graph Laplacian and sparse constraint: Identification of differentially expressed genes and sample clustering on gene expression data. [PDF]
Feng CM, Xu Y, Hou MX, Dai LY, Shang JL.
europepmc +1 more source
Progress in Natural Products Target Discovery Technology
Here, we provide a comprehensive overview of current technologies and recent advancements in therapeutic target discovery for natural products. By systematically synthesizing the principles, methodologies, and practical applications of existing experimental and computational strategies, this work provides a more actionable reference framework for ...
Qiyuan Pan +7 more
wiley +1 more source
The G -invariant graph Laplacian Part I: Convergence rate and eigendecomposition. [PDF]
Rosen E +4 more
europepmc +1 more source
ABSTRACT The analysis of certain properties of the underlying graph of a public transport network generates insights about the network's structure. Hereby, the choice of the graph representation depends on a trade‐off between complexity reduction and information preservation to adequately model a public transport network.
Michael Palk +2 more
wiley +1 more source
Direct Evidence for a Carbon–Carbon One‐Electron σ‐Bond, or a Weak Carbon–Carbon Interaction?
Experiments reporting the existence of a single‐electron C─C σ bond in a synthesized stable radical cation open up new perspectives in the study of the existence of chemical bonds. However, the supporting theoretical results at density functional theory cost do not seem to fully support this evidence.
Costantino Zazza +4 more
wiley +1 more source
Cauchy hyper-graph Laplacian nonnegative matrix factorization for single-cell RNA-sequencing data analysis. [PDF]
Wang GF, Shen L.
europepmc +1 more source
B16C16 and Si16C16 nanocages were investigated via DFT for sensing transformer oil fault gases (C2H4, CO, H2S). BC nanocages exhibit stronger adsorption, reduced energy gaps, enhanced electrical conductivity, and positive sensing responses compared to SiC. NCI and QTAIM analyses reveal covalent and partially covalent interactions.
Khalid Abdullah Alrashidi +3 more
wiley +1 more source
Link Prediction with Swarms of Chiral Quantum Walks
Network reconstruction is a fundamental problem in network biology. We propose a link prediction method based on a swarm of chiral quantum walks. Random phase assignments in each walker's Hamiltonian generator produce complementary dynamics on the same topology.
Gaia Forghieri +3 more
wiley +1 more source
Bounds on separated pairs of subgraphs, eigenvalues and related polynomials
We give a bound on the sizes of two sets of vertices at a given minimum distance (a separated pair of subgraphs) in a graph in terms of polynomials and the spectrum of the graph. We find properties of the polynomial optimizing the bound.
Dam, E.R. van
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