Quantum Chemistry
9,538 papers
Quantum Chemistry Research Context
This Quantum Articles category organizes published quantum research papers so readers can browse focused work by topic, source, and year.
Showing 2869-2880 of 9,538
Research progress on functional carbon quantum dots fluorescent probes for detecting pesticide residues in food.
Tian J, Yang R, Ren X, Wang Q, Qing J, Li W, Wang R, Su Z, Wang C, Lin X, Liu X, Li W, Jia Y, Sun C, Du W
Reshaping and quantifying inter- and intramolecular exchange in signal amplification by reversible exchange of pyruvate
Charbel D. Assaf, Vladimir V. Zhivonitko, Amaia Vicario, Alexander A. Auer, Simon B. Duckett, Jan-Bernd Hövener, Andrey N. Pravdivtsev
Residue-Level Affinity Decomposition via Quantum Electron Density: A Multivariable Framework Applied to HIV-1 Protease Inhibitors.
Gutiérrez-Flores J, Padilla-Bernal G, Sánchez-Juárez C, Méndez-Orduña DM, Serrano Medina J, García-Gutiérrez P, Zubillaga RA, Vargas R
Resolving Conformational Preferences of Monosaccharides from (1)H and (13)C NMR Chemical Shifts Using an Integrated MD and QM Approach.
Plazinski W, Widmalm G
Resolving sequential electron-proton transfer kinetics for electrochemical CO(2) reduction at the Cu(100)/H(2)O interface via a quantum-classical framework.
Yang Y, Fu G
Resonance Raman spectroscopy from ab initio Hagedorn wavepacket dynamics
Davide Barbiero, Léa Zupan, Jiří J. L. Vaníček
Resonant and collective modification of London dispersion interactions under vibrational strong coupling
Marit R. Fiechter, Jeremy O. Richardson
Resonant Continuous-Wave Injection for Tailoring Soliton Molecules in a PM Fiber Laser
Dmitry A. Korobko, Valeria A. Ribenek, Pavel A. Itrin, Galina V. Tertyshnikova, Andrei A. Fotiadi
Resonant Intelligence: Born Rule Fusion of Large Language Model Ensembles
Aaron Jessop
Resource-Efficient Bio-Molecular Docking on a NISQ-era Digital Quantum Computer
Tianqi Chen, Adrian M. Mak, Jianguo Li, Jian Feng Kong, Chandra Verma, Sebastian Maurer-Stroh
Resource-efficient energy-based operator selection in fermionic ADAPT-VQE via exact Hamiltonian transformation
Emanuele Rossi, Erik Rosendahl Kjellgren, Artur F. Izmaylov, Stephan P. A. Sauer, Karl Michael Ziems, Sonia Coriani
Resource-Efficient Hybrid Quantum Neighborhood Selection for Large-Scale Molecular Diversity Optimization
Nicolas Mendes de Araujo, Lester de Abreu Faria