Sentence examples for be used for structure from inspiring English sources
While the purpose of the getMol function could be described as "export as MOL file", the setMol function could be called "import MOL file" and it can be used for structure input in textual form for further structural modification using FlaME (see example 1).
It provides a plethora of chemistry-related data structures and algorithms as well as UI widgets that can be used for structure drawing and editing in graphical user interfaces.
An enhancement for MyChemise is currently being worked on, which will, amongst other things, be able to export SMILES strings [9] that can be used for structure searching in databases.
The proposed method can also be used for structure prediction of polymers to match a target Tg value, by keeping the thermal behavior of a terpolymer constant while independently choosing its chemistry.
We also demonstrate how this information can be used for structure prediction.
In the future, nano-sized crystals forming on the surface of heterogeneous nucleating agents could also be used for structure determination using electron crystallography, removing the need for optimization [20].
In addition, the structural solutions obtained from the in vitro selection can be used for structure-based searches for discovery of analogous aptamers in various genomic databases.
The resulting fragments can be used for structure-based drug design tools such as Fragment-Based Lead Discovery (FBLD).
Therefore, we present a tool that mine database(s) of ligand-receptor complexes and generate a library of fragments for a target receptor so it can be used for structure-based drug design, such as Fragment-Based Lead Discovery (FBLD).
Analytical models report that shear stresses along the CFRP steel interface are noticeably mitigated at geometric discontinuities and the proposed hybrid bond technique can be used for structure-level application.
