Sentence examples for approximate structure from inspiring English sources
This knowledge is used in a combined experimental and theoretical approach to reveal the approximate structure of the crucial enantio-differentiating transition complexes formed by interaction of the reactant α-ketoester and the chiral modifier.
The approximate structure of the oil sludge was analyzed and compared with the structure of conventional bitumen for road construction.
Quenched MD can simulate the process of thermal quenching to obtain an amorphous carbon structure, but its initial approximate structure should be known.
An approximate structure model for polymorph X was derived by removing the pentan-2-yl pentan-2-yl pentan-2-ylthe co-crystal structure (Adisorderl fragmentSection 8).
These employ both conventional substructure search approaches (e.g. ChemAxon, Digital Chemistry), and novel algorithms, in some cases based on various forms of similarity and approximate structure matching (e.g. DecrIPt, IBM).
In order to model a 3D structure, we employed the most approximate structure available.
We describe an intensity-restrained optimization procedure for refining approximate structures of ligands within the protein binding pockets using STD-NMR intensity data on reversibly forming weak complexes.
In response to this conclusion, we are now working on systems that test useful questions with approximate structures (such as determining which factors most influence the choice of helix-bundle topology) and also analyzing how natural proteins achieve unique core conformations (e.g., for side chains on the interior side of a beta sheet, illustrated in the kinemages).
Furthermore, approximating structures, i.e., neural networks, fuzzy systems, etc., are not utilized and, moreover, the backstepping "explosion of complexity" issue is eliminated without residing in filtering, thus deriving a low-complexity design.
In other words, DFT-D provides us with an approximate SX structure for each XRPD structure!
Although these algorithms theoretically classify the approximate protein structure alignment problem as "tractable", they are still computationally too expensive for large-scale protein structure analysis.
