ASH: A Multi‐Scale, Multi‐Theory Modeling Program
ASH is a Python‐based computational chemistry software for multi‐scale and multi‐theory computations (including QM/MM and ONIOM) and MD simulations. The program is designed for flexible workflows of molecular and biomolecular systems, allowing geometry optimizations, numerical frequencies, high‐level thermochemistry, MD and free‐energy simulations, NEB
Ragnar Bjornsson
wiley +1 more source
ABSTRACT The contribution deals with algebraic multigrid (AMG) based preconditioning methods for the iterative solution of a coupled linear system of equations arising in numerical simulations of failure of quasi‐brittle materials using generalized continuum approaches.
Nasser Alkmim +4 more
wiley +1 more source
Event‐Triggered Saturating Control for Synchronization of Lur'e Type Complex Dynamic Networks
ABSTRACT This article addresses the problem of synchronizing discrete‐time Lur'e type complex dynamic networks (CDNs) via dynamic event‐triggered control. In particular, it is considered that the control signal of each node is subject to input saturation. Using the Lyapunov Stability Theory, properties of slope‐restricted nonlinearities, and the linear
C. Lisbôa +3 more
wiley +1 more source
A Survey of Lattice-Based Physical-Layer Security for Wireless Systems with <i>p</i>-Modular Lattice Constructions. [PDF]
Khodaiemehr H +5 more
europepmc +1 more source
Lossless and Lossy Characterization of the State of Perturbed Anharmonic Diatomics: An Information-Theoretic Compaction of Quantum Dynamics. [PDF]
Hamilton JR, Levine RD.
europepmc +1 more source
Integral Betti signatures of brain, climate and financial networks compared to hyperbolic, Euclidean and spherical models. [PDF]
Caputi L, Pidnebesna A, Hlinka J.
europepmc +1 more source
Optimal hyperdimensional representation for learning and cognitive computation. [PDF]
Poduval PP +7 more
europepmc +1 more source
Categorical framework for quantum-resistant zero-trust AI security. [PDF]
Cherkaoui I, Clarke C, Horgan J, Dey I.
europepmc +1 more source
A novel cryptographic framework and mathematical modeling for secure transmission of Parkinson's disease data using RSA and block-based secret sharing. [PDF]
Sambandham T +5 more
europepmc +1 more source
Algebraic methods and computational strategies for pseudoinverse-based MR image reconstruction (Pinv-Recon). [PDF]
Yeung K +11 more
europepmc +1 more source

