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 …
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
Optically active molecular materials, such as organic conjugated polymers and biological
systems, are characterized by strong coupling between electronic and vibrational degrees of …
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 …
to their fascinating photophysical properties. Implementing these emissive organic …
Plant nanobionic sensors for arsenic detection
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 …
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
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 …
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 …
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 …
are of great interest for applications in many fields like medicine, pharmacology, and …
Informing geometric deep learning with electronic interactions to accelerate quantum chemistry
Predicting electronic energies, densities, and related chemical properties can facilitate the
discovery of novel catalysts, medicines, and battery materials. However, existing machine …
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 …
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 …
chemical structure is unknown and its binding mode to DNA remains controversial. Here, we …