Enum FindingCode 

#[non_exhaustive]
pub enum FindingCode {
    RingBridgedComplexity,
    RingSpiro,
    RingFusedDense,
    RingMacrocycle,
    SizeLargeMolecularWeight,
    SizeHighRotatableBondCount,
    StereoCenterCount,
    StereoDensityHigh,
    StereoAnalysisSkipped,
    FunctionalGroupReactive,
    FunctionalGroupDense,
    FragmentPrecedentWeak,
    FragmentPrecedentStrong,
    InputUnsupportedElement,
    InputDisconnected,
    InputUnusualValence,
    InputTooLarge,
}

Machine-readable finding code (AGENTS.md §8.1). Only variants the currently-implemented components emit exist so far; codes for not-yet-implemented components are added alongside those components.

Variants (Non-exhaustive)

Non-exhaustive enums could have additional variants added in future. Therefore, when matching against variants of non-exhaustive enums, an extra wildcard arm must be added to account for any future variants.

RingBridgedComplexity

A bridged polycyclic ring system (bridgehead connectivity).

RingSpiro

A spiro ring junction (two rings sharing exactly one atom).

RingFusedDense

A fused ring system whose fusion density is above the threshold.

RingMacrocycle

A ring at or above the macrocycle size threshold.

SizeLargeMolecularWeight

Molecular weight above the size threshold.

SizeHighRotatableBondCount

Rotatable bond count above the threshold.

StereoCenterCount

At least one tetrahedral stereocenter is present (specified or unspecified — see evidence.value for the count).

StereoDensityHigh

Stereocenter density (centers per heavy atom) above the threshold.

StereoAnalysisSkipped

Stereo analysis could not be run at all for this molecule. Not reachable as of chematic 0.13.0 — the one trigger condition (a negatively charged atom, chematic#267) was an upstream bug, fixed directly rather than worked around. Kept in the schema for compatibility (#[non_exhaustive]), same policy as this project’s other retired-but-not-removed codes.

FunctionalGroupReactive

A Brenk et al. (2008) reactive/unstable structural alert matched — the specific alert name is in explanation, not a separate code (AGENTS.md §8.1: one generic code per component concern, not one per pattern).

FunctionalGroupDense

Distinct functional-group cluster count (Ertl 2017) above the threshold.

FragmentPrecedentWeak

This molecule’s fragments sit at a low percentile of the configured crate::FragmentCorpus’s (AnalysisConfig.fragment_model) own mean-document-frequency distribution — i.e. this molecule’s fragments are, relative to the reference corpus, weakly precedented (unusually rare). Only ever produced when a corpus is configured. Explanatory only since round 21 (option C) — does not contribute to overall.difficulty and never appears in dominant_penalties/dominant_supports; see FragmentPrecedentEvidence and rules.rs’s “Fragment precedent” section for why (round 20 found the corpus-relative signal too corpus-sensitive to trust as a scoring input). The opposite -direction case is FindingCode::FragmentPrecedentStrong.

FragmentPrecedentStrong

This molecule’s fragments sit at a high percentile of the configured crate::FragmentCorpus’s own mean-document-frequency distribution — unusually strong precedent relative to the reference corpus. Only ever produced when a corpus is configured. Explanatory only since round 21 (option C) — same as FindingCode::FragmentPrecedentWeak, does not contribute to overall.difficulty and never appears in dominant_penalties/ dominant_supports.

InputUnsupportedElement

The molecule contains an element outside yomitoki’s supported set.

InputDisconnected

The molecule consists of disconnected fragments.

InputUnusualValence

At least one atom has a valence outside normal ranges for its element.

InputTooLarge

Heavy-atom count exceeds AnalysisConfig.max_heavy_atoms.

Trait Implementations

impl Clone for FindingCode

fn clone(&self) -> FindingCode

Returns a duplicate of the value.

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

Performs copy-assignment from source.

impl Copy for FindingCode

impl Debug for FindingCode

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

Formats the value using the given formatter.

impl<'de> Deserialize<'de> for FindingCode

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

where __D: Deserializer<'de>,

Deserialize this value from the given Serde deserializer.

impl Eq for FindingCode

impl Hash for FindingCode

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 Ord for FindingCode

fn cmp(&self, other: &FindingCode) -> Ordering

This method returns an Ordering between self and other.

fn max(self, other: Self) -> Self

where Self: Sized,

Compares and returns the maximum of two values.

fn min(self, other: Self) -> Self

where Self: Sized,

Compares and returns the minimum of two values.

fn clamp(self, min: Self, max: Self) -> Self

where Self: Sized,

Restrict a value to a certain interval.

impl PartialEq for FindingCode

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

Equality operator ==.

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

Inequality operator !=.

impl PartialOrd for FindingCode

fn partial_cmp(&self, other: &FindingCode) -> Option<Ordering>

This method returns an ordering between self and other values if one exists.

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

Tests less than (for self and other) and is used by the < operator.

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

Tests less than or equal to (for self and other) and is used by the <= operator.

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

Tests greater than (for self and other) and is used by the > operator.

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

Tests greater than or equal to (for self and other) and is used by the >= operator.

impl Serialize for FindingCode

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 FindingCode