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They're molecules constructed by chemistry as opposed to real molecules from nature.
a Average ± standard deviation synthetic accessibility score (SAscore) calculated for molecules constructed by eSynth for individual DUD-E targets (sorted on the x-axis).
Encouragingly, the median SAscore for molecules constructed by eSynth is lower than those for natural products, which is 3.82 for the Nuclei of Bioassays, Biosynthesis and Ecophysiology (NuBBE) database of secondary metabolites and derivatives from the biodiversity of Brazil [48], and 4.30 for the Universal Natural Product Database (UNPD) [49].
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New molecules are constructed by connecting the scaffolds identified with the query substituents.
The molecules are constructed by randomly combining atoms of a group.
However, in order to reduce the potential immunogenicity of the human molecule and to maximize the opportunity to maintain exposures in chronic models, a murine surrogate molecule was constructed by exchanging the human IgG1 Fc sequence portion of sotatercept with its murine IgG2a homolog.
In the quantitative TaqMan real-time PCR assay, a reference molecule was constructed by recombinant PCR and standard curves were set up.
A packing model featuring a density of 1.0 g cm−3 and containing one buffer molecule was constructed by the amorphous cell module.
These molecules are being constructed by zirconocene-coupling methods, and by nucleophilic aromatic substitution reactions of fluorinated aromatic systems.
A series of fully rigid rod rod type amphiphilic molecules have been constructed by using 4,4′-bipyridin-1-ium or 4,4′-bipyridin-1,1′-diium 4,4′-bipyridin-1,1′-diium 4,4′-bipyridin-1,1′-diium 4,4′-bipyridin-1,1′-diiumas a hydrophobic unit.
Chimeric RNA molecules have been constructed by fusion of aptamers with targeted ribozyme [ 73].
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molecules obtained by
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molecules shared by
molecules used by
molecules caused by
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molecules surrounded by
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