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pubchem

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pubchem simplifies the data retrieval from the PubChem API.

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import type { ComputedData, DataType } from '../CompoundData'; import { getComputedDataSection } from './getComputedDataSection'; import { getComputedPropertySection } from './getComputedPropertySection'; /** * Returns the number properties of a compound * * @param data Data of a compound data request to the PubChem API * @param sectionName Name of the section to get the data from * @returns Computed Data */ export function getNumberProperties( data: DataType, sectionName: string, ): ComputedData { const output: ComputedData = { value: null, label: null, reference: { description: null, }, description: null, }; try { const computationalData = getComputedDataSection(data); const section = getComputedPropertySection( computationalData[0], sectionName, ); output.value = section.Value.Number[0]; output.label = sectionName; output.description = section.Description; output.reference.description = section.Reference[0]; if (section.Value.Unit) { output.units = section.Value.Unit; } } catch { /* empty */ } return output; }