Crate xyz_parse

A parser for the XYZ file format

The formatting of the .xyz file format is as follows:

<number of atoms>
comment line
<element> <X> <Y> <Z>
...

Currently the parser does not support extended XYZ format, but may do so in the future

Re-exports

• pub use rust_decimal;

Structs

• Atom
  An atom in a molecule
• Molecule
  A molecule
• Xyz
  A list of molecules

Enums

• AtomParseError
  An error that can occur when parsing an Atom
• MoleculeParseError
  An error that can occur when parsing a Molecule
• XyzParseError
  An error that can occur while parsing an Xyz

Functions

• parse_xyz
  Parse an Xyz string