Molecular mechanism of aggregation‐induced emission
Q Peng, Z Shuai - Aggregate, 2021 - Wiley Online Library
Deep understanding of the inherent luminescence mechanism is essential for the
development of aggregation‐induced emission (AIE) materials and applications. We first …
development of aggregation‐induced emission (AIE) materials and applications. We first …
Theory of long-lived room-temperature phosphorescence in organic aggregates
Conspectus Room-temperature phosphorescence (RTP) with a long afterglow from purely
organic molecular aggregates has recently attracted many investigations because …
organic molecular aggregates has recently attracted many investigations because …
Electrostatic interaction-induced room-temperature phosphorescence in pure organic molecules from QM/MM calculations
Room temperature phosphorescence (RTP) from pure organic material is rare due to the low
phosphorescence quantum efficiency. That is why the recent discovery of crystallization …
phosphorescence quantum efficiency. That is why the recent discovery of crystallization …
Simulation of the folding equilibrium of α-helical peptides: a comparison of the generalized Born approximation with explicit solvent
H Nymeyer, AE Garcia - Proceedings of the National …, 2003 - National Acad Sciences
We compare simulations using the generalized Born/surface area (GB/SA) implicit solvent
model with simulations using explicit solvent (transferable intermolecular potential 3 point …
model with simulations using explicit solvent (transferable intermolecular potential 3 point …
[HTML][HTML] Photocontrol of peptide secondary structure through non-azobenzene photoswitches
The rapidly expanding field of photoswitchable biomolecules is a major frontier in scientific
research and provides unparalleled opportunities for studying biological pathways and …
research and provides unparalleled opportunities for studying biological pathways and …
Insect neuropeptides: structures, chemical modifications and potential for insect control
J Scherkenbeck, T Zdobinsky - Bioorganic & medicinal chemistry, 2009 - Elsevier
Insect neuropeptides are involved in almost all physiological processes in insects, such as
diuresis, ecdysis, pheromone biosynthesis and control of muscle activity. Thus, these small …
diuresis, ecdysis, pheromone biosynthesis and control of muscle activity. Thus, these small …
Enhanced in vivo activity of peptidase-resistant analogs of the insect kinin neuropeptide family
RJ Nachman, A Strey, E Isaac, N Pryor, JD Lopez… - Peptides, 2002 - Elsevier
The diuretic/myotropic insect kinin neuropeptides, which share the common C-terminal
pentapeptide core FX1X2WG-NH2, reveal primary (X2-W) and secondary (N-terminal to F) …
pentapeptide core FX1X2WG-NH2, reveal primary (X2-W) and secondary (N-terminal to F) …
Massively parallel implementation of Steered Molecular Dynamics in Tinker-HP: comparisons of polarizable and non-polarizable simulations of realistic systems
Steered molecular dynamic (SMD) is a powerful technique able to accelerate rare event
sampling in Molecular Dynamics (MD) simulations by applying an external force to a set of …
sampling in Molecular Dynamics (MD) simulations by applying an external force to a set of …
Comparative structure‐activity analysis of insect kinin core analogs on recombinant kinin receptors from Southern cattle tick Boophilus microplus (Acari: Ixodidae) and mosquito …
S Taneja‐Bageshwar, A Strey… - Archives of Insect …, 2006 - Wiley Online Library
The systematic analysis of structure-activity relationships of insect kinins on two
heterologous receptor-expressing systems is described. Previously, kinin receptors from the …
heterologous receptor-expressing systems is described. Previously, kinin receptors from the …
A photoswitchable thioxopeptide bond facilitates the conformation‐activity correlation study of insect kinin
Thioxopeptide bond ψ [CS–N], a nearly isosteric modification of the native peptide bond,
was introduced into insect kinin active core pentapeptide to evaluate the impact of backbone …
was introduced into insect kinin active core pentapeptide to evaluate the impact of backbone …