chemp is a tool for parsing chemical formulas.
takes molecular formula of substance. for given correct formula it extracts information about compound:
- chemical composition
- molar mass
- mass percent of each element in composition
Usage
use chemp;
let compound = parse.unwrap;
// get chemical composition
compound.composition.iter.for_each;
// get molar mass of compound
compound.molar_mass;
println!;
// compound: Compound {
// composition: {
// "Mg": Component {
// element: Magnesium,
// atoms_count: 1,
// mass_percent: 9.861401,
// },
// "S": Component {
// element: Sulfur,
// atoms_count: 1,
// mass_percent: 13.007879,
// },
// "O": Component {
// element: Oxygen,
// atoms_count: 11,
// mass_percent: 71.40498,
// },
// "H": Component {
// element: Hydrogen,
// atoms_count: 14,
// mass_percent: 5.725739,
// },
// },
// molar_mass: 246.466,
// }