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 529-540 of 3,656

Design strategies for fluorene-skeleton near-infrared small-molecule dyes and their NIR-II imaging applications.

Han T, Sun J, Mu S, Huang Q, Liu X, Zhang H

2026 PubMed Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy

Design, construction, and field evaluation of an intelligent solid-state voltage regulator for voltage profile improvement in low-voltage distribution networks.

Mikhak-Beyranvand M, Bastami H, Farhadian AH

2026 PubMed Scientific reports

Design, synthesis, and applications of Naphthalimide-based Mechanofluorophores for multimodal security encryption and anti-counterfeiting technologies.

Prabakaran K, Manivannan R, Jayasudha P, Son YA

2026 PubMed Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy

Design, synthesis, and biological evaluation of a dichloro-substituted schiff base as an α-amylase inhibitor: structural, computational, and molecular dynamics, in-silico approaches.

Chakkarapani N, Velmurugan Y, Hemamalini M, Venkatachalam R

2026 PubMed Journal of biomolecular structure & dynamics

Design, synthesis, bioactivity, DFT, and molecular docking of 4-aminoantipyrine analogs as potential analgesic and anti-inflammatory agents.

Benabbes M, El Moutaouakil Ala Allah A, Ziraoui O, El-Mernissi R, El Baria MK, Benlabchir AA, El Menyiy N, Akhazzane M, Tüzün B, El Harti J, Lamsaouri J

2026 PubMed Computational biology and chemistry

Designable van der Waals Crystal for Artificial Neuronal Cell Mimicking.

Lee J, Kim G, Lee D, Son S, Seok H, Son S, Choi H, Kim G, Back G, Kim H, Park C, Ahn J, Je S, Im C, Cho J, Grzeszczyk M, Kim S, Go E, Shim H, Choi D, Kim M, Kim HU, Jang WJ, Kim T

2026 PubMed Advanced materials (Deerfield Beach, Fla.)

Designing Bioconjugated Ti(3)C(2) MXene QDs with Excellent Two-Photon Absorption Coefficients for Targeted NIR-II Imaging of Triple-Negative Breast Cancer Cells.

Rai S, Pramanik A, Kolawole OP, Gates K, Stark T, Edorodion Z, Kundu S, Barua A, Akula S, Janorkar S, Vedala PR, Han FX, Ray PC

2026 PubMed ACS omega

Designing Magnetic Topological Insulator Trilayers for Highly Efficient Spin-Orbit Torque Switching.

Zhou LJ, Zhuo D, Tay H, Yan ZJ, Xiao P, Liu X, Zhang B, Chang CZ

2026 PubMed Nano letters

Designing stable π-radicals.

Houplin A, Liu CH, Perepichka DF

2026 PubMed Chemical Society reviews

Detection of dissolved Ammonia and trinitrophenol using hydrogel tags doped with pyridine-functionalized AIEgens: A strategy for mitigating ammonium picrate hazards in explosive disposal.

Zhang Y, Xie X, Zhao S, Jiang R, Qi W, Hu L

2026 PubMed Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy

Detection of Muscle Fiber Orientation During Human Tongue Development: Analysis Using Diffusion Tensor Imaging.

Suto S, Kanahashi T, Fujii S, Imai H, Otani H, Yamada S, Takakuwa T

2026 PubMed NMR in biomedicine

Determination of zero-field splitting in magnetically diluted cobalt(II)-based single molecule magnets using circular dichroism Fourier-transform IR spectroscopy.

Borodulina AV, Melnikov AR, Fedin MV, Veber SL

2026 PubMed The Journal of chemical physics