module Chem::Cube

Defined in:

chem/formats/cube.cr

Class Method Summary

• .read(io : IO) : Spatial::Grid

  Returns the grid from io.

• .read(path : Path | String) : Spatial::Grid

  Returns the grid from path.

• .read_info(io : IO) : Spatial::Grid::Info

  Returns the grid information from io without reading the data.

• .read_info(path : Path | String) : Spatial::Grid::Info

  Returns the grid information from path without reading the data.

• .read_structure(io : IO) : Structure

  Returns the structure from io without reading the data.

• .read_structure(path : Path | String) : Structure

  Returns the structure from path without reading the data.

• .write(io : IO, grid : Spatial::Grid, atoms : AtomView | Structure) : Nil

  Writes a grid to io.

• .write(path : Path | String, grid : Spatial::Grid, atoms : AtomView | Structure) : Nil

  Writes a grid to path.

Class Method Detail