Struct ExplicitBond 

pub struct ExplicitBond {
    pub i: usize,
    pub j: usize,
    pub image: [i32; 3],
    pub order: f64,
    pub remove: bool,
}

An explicit bond stored by the user.

Fields

i: usize

First atom index in the asymmetric unit or P1 cell.

j: usize

Second atom index.

image: [i32; 3]

Lattice image of j.

order: f64

Bond order.

remove: bool

When true, remove a perceived bond instead of adding one.

Trait Implementations

impl Clone for ExplicitBond

fn clone(&self) -> Self

Returns a duplicate of the value.

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

Performs copy-assignment from source.

impl Copy for ExplicitBond

impl Debug for ExplicitBond

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

Formats the value using the given formatter.

impl<'de> Deserialize<'de> for ExplicitBond

fn deserialize<__D>(__deserializer: __D) -> Result<Self, __D::Error>

where __D: Deserializer<'de>,

Deserialize this value from the given Serde deserializer.

impl PartialEq for ExplicitBond

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

Equality operator ==.

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

Inequality operator !=.

impl Serialize for ExplicitBond

fn serialize<__S>(&self, __serializer: __S) -> Result<__S::Ok, __S::Error>

where __S: Serializer,

Serialize this value into the given Serde serializer.

impl StructuralPartialEq for ExplicitBond