Machine learning for electronically excited states of molecules

J Westermayr, P Marquetand - Chemical Reviews, 2020 - ACS Publications
Electronically excited states of molecules are at the heart of photochemistry, photophysics,
as well as photobiology and also play a role in material science. Their theoretical description …

Non-adiabatic excited-state molecular dynamics: Theory and applications for modeling photophysics in extended molecular materials

TR Nelson, AJ White, JA Bjorgaard, AE Sifain… - Chemical …, 2020 - ACS Publications
Optically active molecular materials, such as organic conjugated polymers and biological
systems, are characterized by strong coupling between electronic and vibrational degrees of …

Dual-state emission (DSE) in organic fluorophores: design and applications

JL Belmonte-Vázquez, YA Amador-Sánchez… - Chemistry of …, 2021 - ACS Publications
Organic luminescent materials have attracted significant attention in the past few years due
to their fascinating photophysical properties. Implementing these emissive organic …

Plant nanobionic sensors for arsenic detection

TTS Lew, M Park, J Cui, MS Strano - Advanced Materials, 2021 - Wiley Online Library
Arsenic is a highly toxic heavy‐metal pollutant which poses a significant health risk to
humans and other ecosystems. In this work, the natural ability of wild‐type plants to pre …

Enhanced two‐photon absorption of organic chromophores: theoretical and experimental assessments

F Terenziani, C Katan, E Badaeva, S Tretiak… - Advanced …, 2008 - Wiley Online Library
Functional organic materials with enhanced two‐photon absorption lead to new
technologies in the fields of chemistry, biology, and photonics. In this article we review …

Near IR heptamethine cyanine dye–mediated cancer imaging

X Yang, C Shi, R Tong, W Qian, HE Zhau, R Wang… - Clinical cancer …, 2010 - AACR
Purpose: Near-IR fluorescence imaging has great potential for noninvasive in vivo imaging
of tumors. In this study, we show the preferential uptake and retention of two hepatamethine …

Cyanine dyes containing quinoline moieties: history, synthesis, optical properties, and applications

K Ilina, M Henary - Chemistry–A European Journal, 2021 - Wiley Online Library
Cyanine dyes carrying quinoline moieties are an important class of organic molecules that
are of great interest for applications in many fields like medicine, pharmacology, and …

Informing geometric deep learning with electronic interactions to accelerate quantum chemistry

Z Qiao, AS Christensen, M Welborn… - Proceedings of the …, 2022 - National Acad Sciences
Predicting electronic energies, densities, and related chemical properties can facilitate the
discovery of novel catalysts, medicines, and battery materials. However, existing machine …

Recent advances in bioprobes and biolabels based on cyanine dyes

X Ma, L Shi, B Zhang, L Liu, Y Fu, X Zhang - Analytical and bioanalytical …, 2022 - Springer
As a functional dye, cyanine dye promotes the widespread application of bioprobes in the
fields of medicine, genetics and environment, owing to its advantages of good photophysical …

Molecular structure, DNA binding mode, photophysical properties and recommendations for use of SYBR Gold

PJ Kolbeck, W Vanderlinden… - Nucleic acids …, 2021 - academic.oup.com
SYBR Gold is a commonly used and particularly bright fluorescent DNA stain, however, its
chemical structure is unknown and its binding mode to DNA remains controversial. Here, we …