Struct molly::Frame

pub struct Frame {
    pub step: u32,
    pub time: f32,
    pub boxvec: BoxVec,
    pub precision: f32,
    pub positions: Vec<f32>,
}

Fields

step: u32

time: f32

Time in picoseconds.

boxvec: BoxVec

precision: f32

positions: Vec<f32>

Implementations

impl Frame

pub fn coords(&self) -> impl Iterator<Item = Vec3> + '_

Returns an iterator over the coordinates stored in this Frame.

pub fn natoms(&self) -> usize

Returns the number of atoms in this Frame.

Trait Implementations

impl Clone for Frame

fn clone(&self) -> Frame

Returns a copy of the value.

fn clone_from(&mut self, source: &Self)

Performs copy-assignment from source.

impl Debug for Frame

fn fmt(&self, f: &mut Formatter<'_>) -> Result

Formats the value using the given formatter.

impl Default for Frame

fn default() -> Frame

Returns the “default value” for a type.

impl PartialEq for Frame

fn eq(&self, other: &Frame) -> bool

This method tests for self and other values to be equal, and is used by ==.

fn ne(&self, other: &Rhs) -> bool

This method tests for !=. The default implementation is almost always sufficient, and should not be overridden without very good reason.

impl StructuralPartialEq for Frame