2025-08-24 02:01:24 +02:00
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use serde::{Deserialize, Serialize};
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2025-08-26 23:36:29 +02:00
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use std::collections::{BTreeSet, BTreeMap};
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2025-08-23 23:40:19 +02:00
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use std::hash::Hash;
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2025-08-24 02:01:24 +02:00
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use std::fmt;
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2025-08-27 23:58:43 +02:00
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use super::translator::{Formatter, Translator, PrintableWithTranslator};
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use super::element::{IdType, PositiveType, IdState};
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2025-08-26 16:56:08 +02:00
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/// Basic trait for all Set implementations.
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/// Implement IntoIterator for &Self to have .iter() (not required directly by
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/// the trait).
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pub trait BasicSet
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where Self: Clone + Eq + Ord + Default + Serialize + IntoIterator
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+ PrintableWithTranslator,
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for<'de> Self: Deserialize<'de>
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{
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fn is_subset(&self, other: &Self) -> bool;
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fn is_disjoint(&self, other: &Self) -> bool;
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fn union(&self, other: &Self) -> Self;
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fn push(&mut self, other: &Self);
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fn extend(&mut self, other: Option<&Self>);
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fn intersection(&self, other: &Self) -> Self;
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fn subtraction(&self, other: &Self) -> Self;
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fn len(&self) -> usize;
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fn is_empty(&self) -> bool;
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2025-08-23 23:40:19 +02:00
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}
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2025-08-26 16:56:08 +02:00
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pub trait ExtensionsSet {
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fn iter(
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&self
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) -> <&Self as IntoIterator>::IntoIter
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where for<'b> &'b Self: IntoIterator;
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fn split<'a>(
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&'a self,
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trace: &'a [Self]
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) -> Option<(&'a [Self], &'a [Self])>
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where Self: Sized;
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2025-08-23 23:40:19 +02:00
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}
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2025-08-26 16:56:08 +02:00
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/// Implementations for all sets.
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impl<T: BasicSet> ExtensionsSet for T {
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fn iter(&self) -> <&T as IntoIterator>::IntoIter
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where for<'b> &'b T: IntoIterator {
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self.into_iter()
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2025-08-23 23:40:19 +02:00
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}
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2025-08-26 16:56:08 +02:00
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/// Returns the prefix and the loop from a trace.
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fn split<'a>(
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&'a self,
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trace: &'a [Self]
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) -> Option<(&'a [Self], &'a [Self])> {
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let position = trace.iter().rposition(|x| x == self);
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position.map(|pos| trace.split_at(pos))
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2025-08-23 23:40:19 +02:00
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}
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}
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2025-08-26 16:56:08 +02:00
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// -----------------------------------------------------------------------------
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/// Basic set of entities.
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#[derive(Clone, Debug, Default, PartialOrd, Eq, Ord, Serialize, Deserialize)]
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pub struct Set {
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pub identifiers: BTreeSet<IdType>,
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}
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impl BasicSet for Set {
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fn is_subset(&self, other: &Self) -> bool {
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self.identifiers.is_subset(&other.identifiers)
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2025-08-23 23:40:19 +02:00
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}
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2025-08-26 16:56:08 +02:00
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fn is_disjoint(&self, other: &Self) -> bool {
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self.identifiers.is_disjoint(&other.identifiers)
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2025-08-23 23:40:19 +02:00
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}
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// returns the new set a \cup b
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2025-08-26 16:56:08 +02:00
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fn union(&self, other: &Self) -> Self {
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2025-08-26 23:36:29 +02:00
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let mut ret: Self = other.clone();
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2025-08-23 23:40:19 +02:00
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ret.identifiers.extend(self.identifiers.iter());
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ret
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}
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2025-08-26 23:36:29 +02:00
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fn push(&mut self, other: &Self) {
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self.identifiers.extend(other.iter())
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2025-08-26 16:56:08 +02:00
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}
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fn extend(&mut self, other: Option<&Self>) {
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if let Some(other) = other {
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self.identifiers.extend(other);
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2025-08-23 23:40:19 +02:00
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}
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}
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/// returns the new set a \cap b
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2025-08-26 16:56:08 +02:00
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fn intersection(&self, other: &Self) -> Self {
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2025-08-23 23:40:19 +02:00
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// TODO maybe find more efficient way without copy/clone
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2025-08-26 16:56:08 +02:00
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let res: BTreeSet<_> = other
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2025-08-23 23:40:19 +02:00
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.identifiers
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.intersection(&self.identifiers)
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.copied()
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.collect();
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Set { identifiers: res }
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}
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/// returns the new set a ∖ b
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2025-08-26 16:56:08 +02:00
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fn subtraction(&self, other: &Self) -> Self {
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2025-08-23 23:40:19 +02:00
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// TODO maybe find more efficient way without copy/clone
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let res: BTreeSet<_> = self
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.identifiers
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2025-08-26 16:56:08 +02:00
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.difference(&other.identifiers)
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2025-08-23 23:40:19 +02:00
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.copied()
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.collect();
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Set { identifiers: res }
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}
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2025-08-26 16:56:08 +02:00
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fn len(&self) -> usize {
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2025-08-23 23:40:19 +02:00
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self.identifiers.len()
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}
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2025-08-26 16:56:08 +02:00
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fn is_empty(&self) -> bool {
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2025-08-23 23:40:19 +02:00
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self.identifiers.is_empty()
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}
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}
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impl PartialEq for Set {
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fn eq(&self, other: &Self) -> bool {
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self.identifiers.eq(&other.identifiers)
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}
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}
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impl Hash for Set {
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fn hash<H: std::hash::Hasher>(&self, state: &mut H) {
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self.identifiers.hash(state)
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}
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}
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impl IntoIterator for Set {
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type Item = IdType;
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type IntoIter = std::collections::btree_set::IntoIter<Self::Item>;
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fn into_iter(self) -> Self::IntoIter {
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self.identifiers.into_iter()
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}
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}
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2025-08-24 02:01:24 +02:00
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2025-08-26 16:56:08 +02:00
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impl<'a> IntoIterator for &'a Set {
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type Item = &'a IdType;
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type IntoIter = std::collections::btree_set::Iter<'a, IdType>;
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fn into_iter(self) -> Self::IntoIter {
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self.identifiers.iter()
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}
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}
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2025-08-24 02:01:24 +02:00
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impl PrintableWithTranslator for Set {
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fn print(
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&self,
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f: &mut fmt::Formatter,
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translator: &Translator,
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) -> fmt::Result {
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write!(f, "{{")?;
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let mut it = self.iter().peekable();
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while let Some(el) = it.next() {
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if it.peek().is_none() {
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write!(f,
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"{}",
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translator.decode(*el).unwrap_or("Missing".into()))?;
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} else {
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write!(f,
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"{}, ",
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translator.decode(*el).unwrap_or("Missing".into()))?;
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}
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}
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write!(f, "}}")
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}
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}
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2025-08-26 16:56:08 +02:00
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impl<const N: usize> From<[IdType; N]> for Set {
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fn from(arr: [IdType; N]) -> Self {
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Set {
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identifiers: BTreeSet::from(arr),
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}
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}
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}
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impl From<&[IdType]> for Set {
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fn from(arr: &[IdType]) -> Self {
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Set {
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identifiers: BTreeSet::from_iter(arr.to_vec()),
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}
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}
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}
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impl From<Vec<IdType>> for Set {
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fn from(arr: Vec<IdType>) -> Self {
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Set {
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identifiers: BTreeSet::from_iter(arr),
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}
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}
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}
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2025-08-26 23:36:29 +02:00
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2025-08-27 23:58:43 +02:00
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impl Set {
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/// Converts set to positive set. All elements with the same state.
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pub fn to_positive_set(&self, state: IdState) -> PositiveSet {
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PositiveSet { identifiers: self.iter().map(|x| (*x, state)).collect() }
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}
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/// Computes minimized prohibiting set from reactants and inhibitors.
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2025-08-28 16:08:01 +02:00
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/// Computes the powerset of the union of all reactants ∪ inhibitors sets
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/// and checks for each element of that set if they are also in all other
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/// unions. Then minimizes the result.
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2025-08-27 23:58:43 +02:00
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pub fn prohibiting_set(
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reactants: &[Set],
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inhibitors: &[Set],
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) -> Result<Vec<PositiveSet>, String> {
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if reactants.len() != inhibitors.len() {
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return Err(format!("Different length inputs supplied to create \
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prohibiting set. reactants: {:?}, \
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inhibitors: {:?}",
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reactants, inhibitors))
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}
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if let Some((r, i)) =
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reactants.iter()
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.zip(inhibitors.iter())
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.find(|(sr, si)| !sr.intersection(si).is_empty())
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{
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return Err(format!("Element in both reactants and inhibitors when \
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creating prohibiting set. reactants: {:?}, \
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inhibitors: {:?}",
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r, i))
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}
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2025-08-28 16:08:01 +02:00
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let mut t = {
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let union = reactants.iter()
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.zip(inhibitors.iter())
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.map(|(sr, si)| {
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sr.to_positive_set(IdState::Negative)
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.union(&si.to_positive_set(IdState::Positive))
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})
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.collect::<Vec<_>>();
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let union_union = union.iter()
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.fold(PositiveSet::default(), |acc, s| acc.union(s));
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let mut t = union_union.powerset();
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for set in union.iter() {
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t.retain(|el| !el.intersection(set).is_empty());
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}
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t
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};
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2025-08-26 23:36:29 +02:00
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2025-08-27 23:58:43 +02:00
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// minimization
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// remove sets that contain other sets
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2025-08-28 16:08:01 +02:00
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{
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let mut tmp_t = t.clone().into_iter();
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let mut e = tmp_t.next().unwrap_or_default();
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loop {
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let mut modified = false;
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t.retain(|set| {
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if *set == e {
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true
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} else if e.is_subset(set) {
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modified = true;
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false
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} else {
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true
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2025-08-27 23:58:43 +02:00
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}
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2025-08-28 16:08:01 +02:00
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});
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if !modified {
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e = {
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match tmp_t.next() {
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Some(a) => a,
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None => break,
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}
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};
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}
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2025-08-27 23:58:43 +02:00
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}
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2025-08-26 23:36:29 +02:00
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}
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2025-08-27 23:58:43 +02:00
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// replace pair of sets that have a common negative-positive element
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// with set without
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// cannot happen, caught by error "Element in both ..." above
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|
|
|
|
|
// for e in t.clone() {
|
|
|
|
|
|
// let mut removed_e = false;
|
|
|
|
|
|
// let mut position = 0;
|
|
|
|
|
|
// let mut removed_elements = vec![];
|
|
|
|
|
|
// t.retain(|set| {
|
|
|
|
|
|
// if set == &e {
|
|
|
|
|
|
// position += 1;
|
|
|
|
|
|
// true
|
|
|
|
|
|
// } else if removed_e {
|
|
|
|
|
|
// true
|
|
|
|
|
|
// } else if let elements = set.opposite_intersection(&e)
|
|
|
|
|
|
// && !elements.is_empty()
|
|
|
|
|
|
// {
|
|
|
|
|
|
// removed_e = true;
|
|
|
|
|
|
// removed_elements.extend(elements);
|
|
|
|
|
|
// false
|
|
|
|
|
|
// } else {
|
|
|
|
|
|
// position += 1;
|
|
|
|
|
|
// true
|
|
|
|
|
|
// }
|
|
|
|
|
|
// });
|
|
|
|
|
|
// if removed_e {
|
|
|
|
|
|
// let mut set = t.get(position).unwrap().clone();
|
|
|
|
|
|
// set = set.subtraction(&Set::from(removed_elements.clone())
|
|
|
|
|
|
// .to_positive_set(IdState::Positive));
|
|
|
|
|
|
// set = set.subtraction(&Set::from(removed_elements)
|
|
|
|
|
|
// .to_positive_set(IdState::Negative));
|
|
|
|
|
|
// t.remove(position);
|
|
|
|
|
|
// t.push(set);
|
|
|
|
|
|
// }
|
|
|
|
|
|
// }
|
|
|
|
|
|
|
|
|
|
|
|
Ok(t)
|
2025-08-26 23:36:29 +02:00
|
|
|
|
}
|
|
|
|
|
|
}
|
|
|
|
|
|
|
2025-08-27 23:58:43 +02:00
|
|
|
|
// -----------------------------------------------------------------------------
|
|
|
|
|
|
|
2025-08-26 23:36:29 +02:00
|
|
|
|
#[derive(Clone, Debug, Default, PartialOrd, Eq, Ord, Serialize, Deserialize)]
|
|
|
|
|
|
pub struct PositiveSet {
|
|
|
|
|
|
pub identifiers: BTreeMap<IdType, IdState>,
|
|
|
|
|
|
}
|
|
|
|
|
|
|
|
|
|
|
|
impl BasicSet for PositiveSet {
|
|
|
|
|
|
fn is_subset(&self, other: &Self) -> bool {
|
|
|
|
|
|
for (id, s) in self.iter() {
|
|
|
|
|
|
if let Some(s1) = other.identifiers.get(id) {
|
|
|
|
|
|
if s1 != s {
|
|
|
|
|
|
return false
|
|
|
|
|
|
}
|
|
|
|
|
|
} else {
|
|
|
|
|
|
return false
|
|
|
|
|
|
}
|
|
|
|
|
|
}
|
|
|
|
|
|
true
|
|
|
|
|
|
}
|
|
|
|
|
|
|
|
|
|
|
|
fn is_disjoint(&self, other: &Self) -> bool {
|
|
|
|
|
|
for (id, _s) in self.iter() {
|
|
|
|
|
|
if other.identifiers.contains_key(id) {
|
|
|
|
|
|
return false
|
|
|
|
|
|
}
|
|
|
|
|
|
}
|
|
|
|
|
|
true
|
|
|
|
|
|
}
|
|
|
|
|
|
|
|
|
|
|
|
/// ☞ The operation cannot fail, so we prefer self elements to other,
|
|
|
|
|
|
/// but if the reaction system is consistent there wont be any problem.
|
|
|
|
|
|
fn union(&self, other: &Self) -> Self {
|
|
|
|
|
|
let mut ret: Self = other.clone();
|
|
|
|
|
|
ret.identifiers.extend(self.identifiers.iter());
|
|
|
|
|
|
ret
|
|
|
|
|
|
}
|
|
|
|
|
|
|
|
|
|
|
|
fn push(&mut self, other: &Self) {
|
|
|
|
|
|
self.identifiers.extend(other.iter())
|
|
|
|
|
|
}
|
|
|
|
|
|
|
|
|
|
|
|
fn extend(&mut self, other: Option<&Self>) {
|
|
|
|
|
|
if let Some(other) = other {
|
|
|
|
|
|
self.identifiers.extend(other);
|
|
|
|
|
|
}
|
|
|
|
|
|
}
|
|
|
|
|
|
|
|
|
|
|
|
/// ☞ only returns values that are shared among both, meaning if they have
|
|
|
|
|
|
/// different state (positive, negative) they are considered different.
|
|
|
|
|
|
fn intersection(&self, other: &Self) -> Self {
|
|
|
|
|
|
let res: BTreeMap<_, _> = other
|
|
|
|
|
|
.identifiers
|
|
|
|
|
|
.iter()
|
|
|
|
|
|
.filter(|(id, s)| {
|
|
|
|
|
|
if let Some(s1) = self.identifiers.get(id) && s1 == *s {
|
|
|
|
|
|
true
|
|
|
|
|
|
} else {
|
|
|
|
|
|
false
|
|
|
|
|
|
}
|
|
|
|
|
|
})
|
|
|
|
|
|
.map(|(id, s)| (*id, *s))
|
|
|
|
|
|
.collect();
|
|
|
|
|
|
PositiveSet { identifiers: res }
|
|
|
|
|
|
}
|
|
|
|
|
|
|
|
|
|
|
|
/// ☞ returns a ∖ b, values that are shared but with different state are
|
|
|
|
|
|
/// preserved in the subtraction.
|
|
|
|
|
|
fn subtraction(&self, other: &Self) -> Self {
|
|
|
|
|
|
let res: BTreeMap<_, _> = self
|
|
|
|
|
|
.identifiers
|
|
|
|
|
|
.iter()
|
|
|
|
|
|
.filter(|(id, s)| {
|
|
|
|
|
|
if let Some(s1) = other.identifiers.get(id) && s1 == *s {
|
|
|
|
|
|
false
|
|
|
|
|
|
} else {
|
|
|
|
|
|
true
|
|
|
|
|
|
}
|
|
|
|
|
|
})
|
|
|
|
|
|
.map(|(id, s)| (*id, *s))
|
|
|
|
|
|
.collect();
|
|
|
|
|
|
PositiveSet { identifiers: res }
|
|
|
|
|
|
}
|
|
|
|
|
|
|
|
|
|
|
|
fn len(&self) -> usize {
|
|
|
|
|
|
self.identifiers.len()
|
|
|
|
|
|
}
|
|
|
|
|
|
|
|
|
|
|
|
fn is_empty(&self) -> bool {
|
|
|
|
|
|
self.identifiers.is_empty()
|
|
|
|
|
|
}
|
|
|
|
|
|
}
|
|
|
|
|
|
|
|
|
|
|
|
impl PrintableWithTranslator for PositiveSet {
|
|
|
|
|
|
fn print(
|
|
|
|
|
|
&self,
|
|
|
|
|
|
f: &mut fmt::Formatter,
|
|
|
|
|
|
translator: &Translator,
|
|
|
|
|
|
) -> fmt::Result {
|
|
|
|
|
|
write!(f, "{{")?;
|
|
|
|
|
|
let mut it = self.iter().peekable();
|
|
|
|
|
|
while let Some((id, s)) = it.next() {
|
|
|
|
|
|
if it.peek().is_none() {
|
|
|
|
|
|
write!(f,
|
2025-08-27 23:58:43 +02:00
|
|
|
|
"{}",
|
|
|
|
|
|
Formatter::from(translator,
|
|
|
|
|
|
&PositiveType { id: *id, state: *s })
|
|
|
|
|
|
)?;
|
2025-08-26 23:36:29 +02:00
|
|
|
|
} else {
|
|
|
|
|
|
write!(f,
|
2025-08-27 23:58:43 +02:00
|
|
|
|
"{}, ",
|
|
|
|
|
|
Formatter::from(translator,
|
|
|
|
|
|
&PositiveType { id: *id, state: *s })
|
|
|
|
|
|
)?;
|
2025-08-26 23:36:29 +02:00
|
|
|
|
}
|
|
|
|
|
|
}
|
|
|
|
|
|
write!(f, "}}")
|
|
|
|
|
|
}
|
|
|
|
|
|
}
|
|
|
|
|
|
|
|
|
|
|
|
impl PartialEq for PositiveSet {
|
|
|
|
|
|
fn eq(&self, other: &Self) -> bool {
|
|
|
|
|
|
self.identifiers.eq(&other.identifiers)
|
|
|
|
|
|
}
|
|
|
|
|
|
}
|
|
|
|
|
|
|
2025-08-27 23:58:43 +02:00
|
|
|
|
impl Hash for PositiveSet {
|
|
|
|
|
|
fn hash<H: std::hash::Hasher>(&self, state: &mut H) {
|
|
|
|
|
|
self.identifiers.hash(state)
|
|
|
|
|
|
}
|
|
|
|
|
|
}
|
|
|
|
|
|
|
2025-08-26 23:36:29 +02:00
|
|
|
|
impl IntoIterator for PositiveSet {
|
|
|
|
|
|
type Item = (IdType, IdState);
|
|
|
|
|
|
type IntoIter = std::collections::btree_map::IntoIter<IdType, IdState>;
|
|
|
|
|
|
|
|
|
|
|
|
fn into_iter(self) -> Self::IntoIter {
|
|
|
|
|
|
self.identifiers.into_iter()
|
|
|
|
|
|
}
|
|
|
|
|
|
}
|
|
|
|
|
|
|
|
|
|
|
|
impl<'a> IntoIterator for &'a PositiveSet {
|
|
|
|
|
|
type Item = (&'a IdType, &'a IdState);
|
|
|
|
|
|
type IntoIter = std::collections::btree_map::Iter<'a, IdType, IdState>;
|
|
|
|
|
|
|
|
|
|
|
|
fn into_iter(self) -> Self::IntoIter {
|
|
|
|
|
|
self.identifiers.iter()
|
|
|
|
|
|
}
|
|
|
|
|
|
}
|
2025-08-27 23:58:43 +02:00
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
impl<const N: usize> From<[(IdType, IdState); N]> for PositiveSet {
|
|
|
|
|
|
fn from(arr: [(IdType, IdState); N]) -> Self {
|
|
|
|
|
|
PositiveSet {
|
|
|
|
|
|
identifiers: BTreeMap::from(arr),
|
|
|
|
|
|
}
|
|
|
|
|
|
}
|
|
|
|
|
|
}
|
|
|
|
|
|
|
|
|
|
|
|
impl From<&[(IdType, IdState)]> for PositiveSet {
|
|
|
|
|
|
fn from(arr: &[(IdType, IdState)]) -> Self {
|
|
|
|
|
|
PositiveSet {
|
|
|
|
|
|
identifiers: BTreeMap::from_iter(arr.to_vec()),
|
|
|
|
|
|
}
|
|
|
|
|
|
}
|
|
|
|
|
|
}
|
|
|
|
|
|
|
|
|
|
|
|
impl From<Vec<(IdType, IdState)>> for PositiveSet {
|
|
|
|
|
|
fn from(arr: Vec<(IdType, IdState)>) -> Self {
|
|
|
|
|
|
PositiveSet {
|
|
|
|
|
|
identifiers: BTreeMap::from_iter(arr),
|
|
|
|
|
|
}
|
|
|
|
|
|
}
|
|
|
|
|
|
}
|
|
|
|
|
|
|
|
|
|
|
|
impl PositiveSet {
|
|
|
|
|
|
pub fn powerset(&self) -> Vec<Self> {
|
|
|
|
|
|
self.into_iter().fold({
|
|
|
|
|
|
let mut asd = Vec::with_capacity(2_usize.pow(self.len() as u32));
|
|
|
|
|
|
asd.push(vec![]);
|
|
|
|
|
|
asd
|
|
|
|
|
|
}, |mut p, x| {
|
|
|
|
|
|
let i = p.clone().into_iter()
|
|
|
|
|
|
.map(|mut s| {
|
|
|
|
|
|
s.push(x);
|
|
|
|
|
|
s
|
|
|
|
|
|
});
|
|
|
|
|
|
p.extend(i);
|
|
|
|
|
|
p
|
|
|
|
|
|
}).into_iter()
|
|
|
|
|
|
.map(|x| Self::from(x.into_iter()
|
|
|
|
|
|
.map(|(el, s)| (*el, *s))
|
|
|
|
|
|
.collect::<Vec<_>>()))
|
|
|
|
|
|
.collect::<Vec<_>>()
|
|
|
|
|
|
}
|
|
|
|
|
|
|
|
|
|
|
|
pub fn opposite_intersection(&self, other: &Self) -> Vec<IdType> {
|
|
|
|
|
|
let mut ret = vec![];
|
|
|
|
|
|
for (el, state) in self {
|
|
|
|
|
|
if let Some(state2) = other.identifiers.get(el) && *state == !*state2 {
|
|
|
|
|
|
ret.push(*el);
|
|
|
|
|
|
}
|
|
|
|
|
|
}
|
|
|
|
|
|
ret
|
|
|
|
|
|
}
|
|
|
|
|
|
}
|