Struct MonomerUnit 

pub struct MonomerUnit {
    pub smiles: String,
    pub fraction: f64,
}

Composition unit for copolymer chains.

Stores a single repeat unit type with its molar fraction in the chain.

Fields

smiles: String

SMILES string of the repeat unit (e.g. “CC” for ethylene).

fraction: f64

Molar fraction of this unit in the chain (0.0–1.0).

Implementations

impl MonomerUnit

pub fn new(smiles: impl Into<String>, fraction: f64) -> Self

Creates a new MonomerUnit.

Trait Implementations

impl Clone for MonomerUnit

fn clone(&self) -> MonomerUnit

Returns a duplicate of the value.

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

Performs copy-assignment from source.

impl Debug for MonomerUnit

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

Formats the value using the given formatter.

impl PartialEq for MonomerUnit

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

Tests for self and other values to be equal, and is used by ==.

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

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

impl StructuralPartialEq for MonomerUnit