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 3205-3216 of 9,538
Structure and biochemical analyses suggest that PrkA/YeaG protein of Thermus thermophilus functions as a putative molecular chaperone.
Torii M, Kanno R, Mizoguchi A, Humbel BM, Tani K, Masui R
Structure and Luminescence Regulation in Y(3)Al(5)O(12):Cr(3+) via Cation Substitution to Achieve Broadband Near-Infrared Emitting Garnet Phosphor.
Meng Q, Zhang Y, Li X, Yu W, Wang Y, Xu Z, Li JG
Structure and vibrational spectra of formamidinium bromide.
Zamolotskikh S, Smirnov M, Pankin D, Roginskii E
Structure of Fluoride Anion Aqueous Solution Derived from X-ray Spectroscopy.
Carravetta V, Söderström J, de Brito AN, Öhrwall G, Ågren H, Rubensson JE, Agåker M, Ekholm V, Tokushima T, Ghosh A, Björneholm O
Structure orientation determined in transmission and reflection: q-plate
Hsin-Hui Huang, Meguya Ryu, Shuji Kamegaki, Haoran Mu, Eulalia Puig Vilardell, Vijayakumar Anand, Jitraporn Vongsvivut, Nguyen Hoai An Le, Tomas Katkus, Gediminas Seniutinas, Junko Morikawa, Saulius Juodkazis
Structure-activity relationship and adsorption behavior of a thiazole-derived Schiff base corrosion inhibitor for mild steel: integrated experimental and theoretical study.
Aghamajidi F, Khalili MR, Masumi S, Mahdavi S, Tavangar R, Pour-Ali S
Structure-dependent inhibition of human carboxylesterase 1 by organophosphate esters: integrated in vitro profiling and 3D-QSAR interpretation.
Cao Z, Men S, Li Z, Liu G, Su Q, Chen X, Che X, Jin H
Structure-dependent reactive oxygen species generation by scintillator-free X-ray-activated porphyrins: insights into charge effects and internal conversion quantum yield.
Aramaki S, Okazaki S, Ji Q, Dubail M, Shogo T, Zhang C, Li W, Kaminaga K, Ishiwata H, Igarashi R, Yada R, Sakamoto M, Wakabayashi K, Konishi K, Shimizu K, Kahyo T, Setou M, Nakamura K
Structure-ecotoxicity relationships and risk assessment of 0D-3D carbon nanomaterials across aquatic trophic levels.
Boncel S, Szozda N, Kalka J, Blacha A, Ruczka S, Małecka M, Cichy P
Structure-induced enhancement of charge transport in DNA via bis-daunomycin intercalation.
Pardhi K, Masaram K, Patil B, Chandra S, Singh RK, More AM, Patil SR
Structure-informed prediction of organic matter thermodynamics from quantum chemistry and machine learning
Thomas P. Sibille, Klaus-Holger Knorr, Oliver J. Lechtenfeld, Maximilian P. Lau
Structure-property relationships in chalcones with extended π-conjugation: ICT perturbation and red fluorescence.
Corbin B, Houglan P, Chen WY, Ziegler CJ, Pang Y