Quantum Chemistry

8,661 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 241-252 of 8,661

Ansätz Expressivity and Optimization in Variational Quantum Simulations of Transverse-field Ising Model Across System Sizes

Ashutosh P. Tripathi, Nilmani Mathur, Vikram Tripathi

2026 arXiv arXiv preprint

Anti-Breast Cancer Effects of Carbon Quantum Dots: In Vivo Angiogenesis and Arginase Co-Inhibition.

Singh G, Maity S, Yadav DD, Das T, Wasnik K, Pradhan R, Kudada AS, Pareek D, Patra S, Mourya A, Panda S, Batra T, Paik P

2026 PubMed ACS applied bio materials

Anti-inflammatory steroidal glycosides from Allium chinense G. Don.

Zu Y, Liu X, Xu J, Xiang L, He X, Wang Y

2026 PubMed Phytochemistry

Antibacterial flavonoid derivatives: in silico ADMET, DFT, Molecular Docking, MD Simulation and in vitro verification.

Ishfaq A, Tajammal A, Maira R, Qureshi AW, Aleeza B, Basra MAR

2026 PubMed In silico pharmacology

Antibiofilm biosynthetic terpene derivatives against clinically and food-relevant bacteria, including synergistic interactions with <b>β</b> -lactam antibiotics: quantum chemical calculations, molecular docking and ADMET study

Rafaela Mesquita Bastos Cavalcante, Ana Maria Aguiar Nascimento, Rhanna Karyne Rodrigues Muniz, Jéssica Híade Silva Cristino, Victor Moreira de Oliveira, Emmanuel Silva Marinho, Marcia Machado Marinho, Francisco Nithael Melo Lucio, Jesyka Macedo Guedes, Glaydson Leandro Farias Mendonça, Thiago dos Santos Francisco, Francisco Ferdinando Mesquita Cajazeiras, Jaíza Maria Lima Dias, Victor Alves Carneiro, Hélcio Silva dos Santos

2026 Crossref Biofouling

Anticonvulsant activity of aza-Biginelli derivatives related to JM-II-43A and HSAB-based rationalization of their pharmacological profile.

Ríos-Guerra H, Prada-Ramírez HA, Velasco-Bejarano B, López-Martínez M, Espinosa-Raya JE, Briones-Arandas A, Miranda-Ruvalcaba R, Nicolás-Vázquez MI, Gómez-Pliego R

2026 PubMed Journal of computer-aided molecular design

Antihyperglycemic nor-chamigrane sesquiterpenoids from the fungus Antrodiella albocinnanmomea.

Liu H, Du J, Li H, Yu W, Liang Y, He J, Feng T

2026 PubMed Phytochemistry

Antimony Dopant-Driven Monomer-Dimer Structural Transition in a Zero-Dimensional Indium Halide Hybrid.

Kudlu A, Sarma D, Kumar Das D, Sunil A, Maliakal TJ, Mahata A, Kundu J

2026 PubMed The journal of physical chemistry letters

ANTIOXIDANT ACTIVITY AND DFT STUDIES OF ETHYL 2-(2-((6-METHYL-4-OXO-4H-CHROMEN-3-YL) METHYLENE)HYDRAZINYL)THIAZOLE-4-CARBOXYLATE

Adriana GROZAV, Gabriel MARC, Cristina AZAROV, Violeta NECULA, Smaranda ONIGA, Tamas LOVASZ, Ovidiu CRIȘAN

2026 DOAJ Studia Universitatis Babes-Bolyai Chemia

Applicability of simplified alpha spectroscopy for radionuclidic purity tests at 225Ac production sites.

Mihei Y, Tani K, Ichinose J, Nagatsu K, Naito M, Fukushi M, Kurihara O, Inoue K

2026 PubMed Radiation protection dosimetry

Application of a FRET sensor based on Altan-harbvr-derived carbon quantum dots for Escherichia coli detection

Rile Ou, Denggerile Ao, Lu Ga, Ailing Su, Lan Yu, Jun Ai

2026 Crossref Journal of Photochemistry and Photobiology A: Chemistry

Application of microfluidic chip coupled with carbon dots-MOF-enriched chromogenic membrane in the detection of various perfluorinated compounds.

Yuan Y, Jia H, Liu J, Gao F, Zhu X, An Z, Wang J

2026 PubMed Journal of hazardous materials