Enum Error 

pub enum Error {
    AtomIdx {
        provided: u16,
        bond_idx: usize,
        atom: u8,
        max: usize,
    },
    BondMult {
        provided: u16,
        bond_idx: usize,
    },
    AtomicNum {
        provided: u8,
        atom_idx: usize,
    },
    ParallelBonds {
        bond1: usize,
        bond2: usize,
    },
}

A pre-condition violation that may cause undefined behavior when generating coordinates.

These pre-conditions correspond to those documented in gen_coords_unchecked.

Variants

AtomIdx

An atom index in a bond exceeded the maximum possible value

Fields

provided: u16

The invalid atom index that was found

bond_idx: usize

The index of the invalid bond

atom: u8

The index of the atom within the bond (0 or 1)

max: usize

The maximum valid atom index

BondMult

One of the bond multiplicities was not ∈ {1,2,3}

Fields

provided: u16

The invalid bond multiplicity that was found

bond_idx: usize

The index of the invalid bond

AtomicNum

One of the atoms contained an atomic number for an atom that doesn’t exist

Fields

provided: u8

The invalid atomic number that was found

atom_idx: usize

The index of the invalid atom

ParallelBonds

The provided bonds contained a parallel bond

Fields

bond1: usize

The first parallel bond found

bond2: usize

The second parallel bond found

Trait Implementations

impl Clone for Error

fn clone(&self) -> Error

Returns a duplicate of the value.

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

Performs copy-assignment from source.

impl Debug for Error

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

Formats the value using the given formatter.

impl Display for Error

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

Formats the value using the given formatter.

impl Error for Error

fn source(&self) -> Option<&(dyn Error + 'static)>

Returns the lower-level source of this error, if any.

fn description(&self) -> &str

👎Deprecated since 1.42.0: use the Display impl or to_string()

fn cause(&self) -> Option<&dyn Error>

👎Deprecated since 1.33.0: replaced by Error::source, which can support downcasting

fn provide<'a>(&'a self, request: &mut Request<'a>)

🔬This is a nightly-only experimental API. (error_generic_member_access)

Provides type-based access to context intended for error reports.

impl Hash for Error

fn hash<__H: Hasher>(&self, state: &mut __H)

Feeds this value into the given Hasher.

fn hash_slice<H>(data: &[Self], state: &mut H)

where H: Hasher, Self: Sized,

Feeds a slice of this type into the given Hasher.

impl PartialEq for Error

fn eq(&self, other: &Error) -> 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 Eq for Error

impl StructuralPartialEq for Error