A drug-likeness toolbox facilitates ADMET study in drug discovery
CY Jia, JY Li, GF Hao, GF Yang - Drug discovery today, 2020 - Elsevier
Highlights • Online resources facilitate in silico drug-likeness study. • Databases gathering
high quality and up to date data are essential for drug-likeness evaluation. • Web servers for …
high quality and up to date data are essential for drug-likeness evaluation. • Web servers for …
Stochastic theory of nonequilibrium steady states. Part II: Applications in chemical biophysics
The mathematical theory of nonequilibrium steady state (NESS) has a natural application in
open biochemical systems which have sustained source(s) and sink(s) in terms of a …
open biochemical systems which have sustained source(s) and sink(s) in terms of a …
Chemical manipulation of abscisic acid signaling: a new approach to abiotic and biotic stress management in agriculture
The phytohormone abscisic acid (ABA) is the best‐known stress signaling molecule in
plants. ABA protects sessile land plants from biotic and abiotic stresses. The conserved …
plants. ABA protects sessile land plants from biotic and abiotic stresses. The conserved …
Acoustic topological insulator and robust one-way sound transport
Topological design of materials enables topological symmetries and facilitates unique
backscattering-immune wave transport 1 , 2 , 3 , 4 , 5 , 6 , 7 , 8 , 9 , 10 , 11 , 12 , 13 , 14 , 15 , 16 , …
backscattering-immune wave transport 1 , 2 , 3 , 4 , 5 , 6 , 7 , 8 , 9 , 10 , 11 , 12 , 13 , 14 , 15 , 16 , …
[HTML][HTML] Mechanism of transcriptional bursting in bacteria
Transcription of highly expressed genes has been shown to occur in stochastic bursts. But
the origin of such ubiquitous phenomenon has not been understood. Here, we present the …
the origin of such ubiquitous phenomenon has not been understood. Here, we present the …
Enhanced efflux activity facilitates drug tolerance in dormant bacterial cells
Natural variations in gene expression provide a mechanism for multiple phenotypes to arise
in an isogenic bacterial population. In particular, a sub-group termed persisters show high …
in an isogenic bacterial population. In particular, a sub-group termed persisters show high …
Single-cell RNA-seq reveals the diversity of trophoblast subtypes and patterns of differentiation in the human placenta
The placenta is crucial for a successful pregnancy and the health of both the fetus and the
pregnant woman. However, how the human trophoblast lineage is regulated, including the …
pregnant woman. However, how the human trophoblast lineage is regulated, including the …
The enhanced photoreduction of Cr (VI) to Cr (III) using carbon dots coupled TiO2 mesocrystals
The photocatalytic reduction efficiency of hexavalent chromium (Cr 2 O 7 2− (Cr(VI)) is
suffering from high recombination of photoinduced charges, poor adsorption capacity of Cr(VI), …
suffering from high recombination of photoinduced charges, poor adsorption capacity of Cr(VI), …
Probing allostery through DNA
Allostery is well documented for proteins but less recognized for DNA-protein interactions.
Here, we report that specific binding of a protein on DNA is substantially stabilized or …
Here, we report that specific binding of a protein on DNA is substantially stabilized or …
Physical origins of entropy production, free energy dissipation, and their mathematical representations
A unifying mathematical theory of nonequilibrium thermodynamics of stochastic systems in
terms of master equations is presented. As generalizations of isothermal entropy and free …
terms of master equations is presented. As generalizations of isothermal entropy and free …