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This compound definition is in accord with clinical practice.
To identify promising enzyme candidates that catalyze novel biochemical reactions to synthesize desired chemicals, a system framework that follows the steps of target compound definition, route generation, prioritization, and parameter optimization was developed.
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But the implication of this idea for the definitions of hylomorphic compounds is obvious: since matter appears to be a part of such a compound, the definition of the compound will include, as a part, the definitions of its material components.
Chemistry ontology rule 2: A compound class definition may be built from logically connected SMARTS criteria.
The outcome variable in the validation sample differs in that an ANC cutoff point of 0.5 × 10/liter is used in the compound outcome definition.
This network analysis highlights specific dependences in the regulation of VOC releases, which partly overlap with large compound class definition (Fig. 2A).
When using a BRD4 inhibitory "probe compound" (for definition, see Box 1), discovered at the Dana-Farber Cancer Instituteffects-leukemic effects across genomic AML subtypes were precisely recapitulated and found to largely depend on blocking the oncogenic transcription factor MYC (Zuber et al, 2011).
The International Union of Pure and Applied Chemistry IUPACC) has developed a comprehensive terminology of general chemical terms and compound class definitions [19] that can provide a guidance for the development of an expert chemical ontology.
First proposals have been made in [11] for example on what is meant by broad and narrow compound class definitions, potentially also described by terms such as "derivatives", "scaffolds" or "backbone".
Organometallic compounds by definition contain at least one carbon-metal bond.
Thus, any expert chemical ontology will appreciate this knowledge and the androstane compound class structural definition needs to contain a definition that any androstane shall NOT contain a carbon substitution at the C-17 position.
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