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Quantum chemical calculations on SNC80 show that protonation is preferred at the basic N4 atom over the alternative N1 atom, accordingly N4 protonation may contribute significantly to ligand receptor interactions under physiologically relevant conditions.
Whether an artificially designed negative-index structure could be regarded as a homogeneous medium or not rests with the ratio of its structural unit (man-made atom) over the operation wavelength.
The polycondensation enhancement to form –P O Si O P– linkages (PSP) and the increase of the Q2 unit (two bridging oxygens per phosphorus atom) over the Q3 unit (three bridging oxygens per phosphorus atom) as a function of the acid in the order SA
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The organization of aluminium atoms over the 2-D hexagonal structure of graphene substrate has studied with the molecular dynamics simulations.
The analysis of the "amide I" and "amide II" regions provided solid proof that the Li+ ions bond to the urea carbonyl oxygen atoms over the entire range of salt concentration studied.
The γ-Fe[N]/γ′-Fe4N1 − x phase boundaries, the lattice parameters and the distribution of N atoms over the octahedral interstitial sites are calculated by applying the tetrahedron approximation.
We determine the energetically lowest configurations for decorations with a varying number of decorating atoms (2≤n≤32) for alkali metals, alkaline-earth metals as well as some other important elements and find that the dense uniform distribution of the decorating atoms over the surface of the C60, desired for hydrogen storage, can be obtained only for a few elements.
The lowest-conduction band at Γ point almost comes from the pz orbital of Te atoms over the entire range of x from 0 to 1, indicating that the SOC of (Bi1−xSbx 2Te3 is strong enough to inverse the band and the topological insulator phase remains for (Bi1−xSbx 2Te3 with, which agrees with the experimentally observation that the topological surface states are shown to exit with 26,27.
As discussed earlier, the lidargram represents a time history of vertical distribution of Na atoms over the lidar location.
He also thinks that wires may have advantages as magnetic traps for atoms over the more bulky systems now in use.
The central idea of the proposed 3SD is to identify principal atoms from an adaptive over-complete dictionary relying on the occurrence frequency of atoms over the data set (Eq. (8)).
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Justyna Jupowicz-Kozak
CEO of Professional Science Editing for Scientists @ prosciediting.com