Now showing items 3111-3120 of 3138
Comparison of the MSMS and NanoShaper molecular surface triangulation codes in the TABI Poisson–Boltzmann solver
(John Wiley & Sons, Inc., 2021-08-15)
The Poisson–Boltzmann (PB) implicit solvent model is a popular framework for studying the electrostatics of solvated biomolecules. In this model the dielectric interface between the biomolecule and solvent is often taken ...
CPS K 843 Radiation-induced crosslinking: Effect on structure of polyethylene
(Steinkopff-Verlag; Steinkopff ; Springer Science+Business Media, 1985-02)
Branched polyethylene irradiated (0–400 Mrad) with a Co 60 source at room temperature under vacuum was studied by density, wide- and small-angle X-ray scattering (WAXS and SAXS) measurements. The radiation effects on the ...
Nitric Oxide Release for Enhanced Biocompatibility and Analytical Performance of Implantable Electrochemical Sensors
(Wiley Periodicals, Inc.ASM Press, 2021-09)
The real‐time, continuous monitoring of glucose/lactate, blood gases and electrolytes by implantable electrochemical sensors holds significant value for critically ill and diabetic patients. However, the wide‐spread use ...
Calcium‐Ion Binding Mediates the Reversible Interconversion of Cis and Trans Peroxido Dicopper Cores
(ElsevierWiley Periodicals, Inc., 2021-09-01)
Coupled dinuclear copper oxygen cores (Cu2O2) featured in type III copper proteins (hemocyanin, tyrosinase, catechol oxidase) are vital for O2 transport and substrate oxidation in many organisms. μ‐1,2‐cis peroxido dicopper ...
Synergy and Antagonism between Allosteric and Active‐Site Inhibitors of Abl Tyrosine Kinase
(Wiley Periodicals, Inc., 2021-09-06)
Allosteric inhibitors of Abl kinase are being explored in the clinic, often in combination with ATP‐site inhibitors of Abl kinase. However, there are conflicting data on whether both ATP‐competitive inhibitors and ...
An Open- Shell Coronoid with Hybrid Chichibabin- Schlenk Conjugation
(Wiley Periodicals, Inc., 2021-10-04)
A hexaradicaloid molecule with alternating Kekulé and non- Kekulé connectivities between adjacent spin centers was obtained by fusing two conjugation motifs in Chichibabin and Schlenk hydrocarbons into a coronoid ...
Triggered Reversible Disassembly of an Engineered Protein Nanocage**
(Wiley Periodicals, Inc., 2021-11-15)
Protein nanocages play crucial roles in sub- cellular compartmentalization and spatial control in all domains of life and have been used as biomolecular tools for applications in biocatalysis, drug delivery, and ...
Accelerating the 3D reference interaction site model theory of molecular solvation with treecode summation and cut-offs
(John Wiley & Sons, Inc., 2022-07-05)
The 3D reference interaction site model (3D-RISM) of molecular solvation is a powerful tool for computing the equilibrium thermodynamics and density distributions of solvents, such as water and co-ions, around solute ...
Total Synthesis of (+)-Cochlearol B by an Approach Based on a Catellani Reaction and Visible-Light-Enabled [2+2] Cycloaddition**
(SpringerWiley Periodicals, Inc., 2022-08-01)
A 14-step synthesis of (+)-cochlearol B is reported. This renoprotective meroterpenoid features a unique core structure containing a densely substituted cyclobutane ring with three stereocenters. Our strategy employed an ...