Enum FpType 

pub enum FpType {
    Ecfp4,
    Ecfp6,
    Ecfp4Chiral,
    Fcfp4,
    Maccs,
    TopoPath,
}

Which fingerprint type to use for the similarity search.

Variants

Ecfp4

ECFP4 (Morgan radius=2, 2048 bits). Default.

Ecfp6

ECFP6 (Morgan radius=3, 2048 bits).

Ecfp4Chiral

ECFP4 with chirality encoding enabled.

Fcfp4

FCFP4 (feature-based circular FP).

Maccs

MACCS 166-bit structural keys.

TopoPath

Topological path FP (max_len=7, 2048 bits).

Trait Implementations

impl Clone for FpType

fn clone(&self) -> FpType

Returns a duplicate of the value.

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

Performs copy-assignment from source.

impl Copy for FpType

impl Debug for FpType

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

Formats the value using the given formatter.

impl Default for FpType

fn default() -> FpType

Returns the “default value” for a type.

impl Eq for FpType

impl PartialEq for FpType

fn eq(&self, other: &FpType) -> 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 FpType