Quantum Chemistry
3,656 papers from PubMed
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 2617-2628 of 3,656
Structure assignment, conformational properties and discovery of potential targets of the Ugi cinnamic adduct NGI25.
Georgiou N, Gouleni N, Chontzopoulou E, Skoufas GS, Gkionis A, Tzeli D, Vassiliou S, Mavromoustakos T
Sulfication-induced non-radiative electron-hole recombination dynamics in graphene quantum dots for tuning photocatalytic performance.
Cui P, Xue Y
Sulfuric acid induced-synthesis coupled with ethanol extraction-water precipitation purification method for orange fluorescent carbon dots with dual-emission: Application for methyl blue detection and cell imaging.
Yang L, Wang D, Gong Y, Quan T, Tao Y, Liu S, Wang L, Wang J, Tian M, Gao D
The multiple roles of phenols in the degradation of aniline contaminants by sulfate radicals: A combined study of DFT calculations and experiments.
Li M, Duan P, Huo Y, Jiang J, Zhou Y, Ma Y, Jin Z, Mei Q, Xie J, He M
The Role of Quantic Molecular Resonance (QMR) in the Treatment of Inferior Turbinate Hypertrophy (ITH): Our Experience With Long-Term Follow-Up in Allergic and Nonallergic Rhinitis Refractory to Medical Therapy. Preliminary Results.
Ricciardiello F, Pisani D, Viola P, Pellini R, Russo G, Longo G, Chiarella G, Oliva F, Romano D, Petruzzi G, Mazzone S
Theoretical Exploitation of 1,2,3,4,5,6-Hexachloro- and 1,2,3,4,5,6-Hexafluorocyclohexane Isomers as Biologically Active Compounds.
Martins FA, Freitas MP
Theoretical study on the origin of the dual phosphorescence emission from organic aggregates at room temperature.
Li Q, He Y, Lv K, Ma H
Theoretical study on the vibrational spectra and potential energy curves for SiC (X(3)Π) and SiS (X(1)Σ(+)) molecules.
Fan Q, Tian H, Fan Z, Li H, Fu J, Ma J, Xie F
Towards Luminescent Vanadium(II) Complexes with Slow Magnetic Relaxation and Quantum Coherence.
Dorn M, Hunger D, Förster C, Naumann R, van Slageren J, Heinze K
X-ray induced luminescence spectroscopy for DNA damaging intermediates aided by a monochromatic synchrotron radiation.
Terao Y, Kumagai Y, Suzuki I, Tsuchiya T, Ukai M, Yokoya A, Fujii K, Fukuda Y, Saitoh Y
4-acetamido-3-nitrobenzoic acid - structural, quantum chemical studies, ADMET and molecular docking studies of SARS-CoV2.
Gurumallappa, Arun Renganathan RR, Hema MK, Karthik CS, Rani S, Nethaji M, Jayanth HS, Mallu P, Lokanath NK, Ravishankar Rai V
ACE2-derived peptides interact with the RBD domain of SARS-CoV-2 spike glycoprotein, disrupting the interaction with the human ACE2 receptor.
Souza PFN, Amaral JL, Bezerra LP, Lopes FES, Freire VN, Oliveira JTA, Freitas CDT