Implement cosine similarity and cosinepair (#327)

* Implement cosine similarity and cosinepair
This commit is contained in:
Lorenzo
2025-09-27 11:08:57 +01:00
committed by GitHub
parent 4841791b7e
commit 09be4681cf
9 changed files with 1018 additions and 12 deletions
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name = "smartcore" name = "smartcore"
description = "Machine Learning in Rust." description = "Machine Learning in Rust."
homepage = "https://smartcorelib.org" homepage = "https://smartcorelib.org"
version = "0.4.2" version = "0.4.3"
authors = ["smartcore Developers"] authors = ["smartcore Developers"]
edition = "2021" edition = "2021"
license = "Apache-2.0" license = "Apache-2.0"
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///
/// ### CosinePair: Data-structure for the dynamic closest-pair problem.
///
/// Reference:
/// Eppstein, David: Fast hierarchical clustering and other applications of
/// dynamic closest pairs. Journal of Experimental Algorithmics 5 (2000) 1.
///
/// Example:
/// ```
/// use smartcore::metrics::distance::PairwiseDistance;
/// use smartcore::linalg::basic::matrix::DenseMatrix;
/// use smartcore::algorithm::neighbour::cosinepair::CosinePair;
/// let x = DenseMatrix::<f64>::from_2d_array(&[
/// &[5.1, 3.5, 1.4, 0.2],
/// &[4.9, 3.0, 1.4, 0.2],
/// &[4.7, 3.2, 1.3, 0.2],
/// &[4.6, 3.1, 1.5, 0.2],
/// &[5.0, 3.6, 1.4, 0.2],
/// &[5.4, 3.9, 1.7, 0.4],
/// ]).unwrap();
/// let cosinepair = CosinePair::new(&x);
/// let closest_pair: PairwiseDistance<f64> = cosinepair.unwrap().closest_pair();
/// ```
/// <script src="https://polyfill.io/v3/polyfill.min.js?features=es6"></script>
/// <script id="MathJax-script" async src="https://cdn.jsdelivr.net/npm/mathjax@3/es5/tex-mml-chtml.js"></script>
use std::collections::HashMap;
use num::Bounded;
use crate::error::{Failed, FailedError};
use crate::linalg::basic::arrays::{Array1, Array2};
use crate::metrics::distance::cosine::Cosine;
use crate::metrics::distance::{Distance, PairwiseDistance};
use crate::numbers::floatnum::FloatNumber;
use crate::numbers::realnum::RealNumber;
///
/// Inspired by Python implementation:
/// <https://github.com/carsonfarmer/fastpair/blob/b8b4d3000ab6f795a878936667eee1b557bf353d/fastpair/base.py>
/// MIT License (MIT) Copyright (c) 2016 Carson Farmer
///
/// affinity used is Cosine as it is the most used
///
#[derive(Debug, Clone)]
pub struct CosinePair<'a, T: RealNumber + FloatNumber, M: Array2<T>> {
/// initial matrix
pub samples: &'a M,
/// closest pair hashmap (connectivity matrix for closest pairs)
pub distances: HashMap<usize, PairwiseDistance<T>>,
/// conga line used to keep track of the closest pair
pub neighbours: Vec<usize>,
}
impl<'a, T: RealNumber + FloatNumber, M: Array2<T>> CosinePair<'a, T, M> {
/// Constructor
/// Instantiate and initialize the algorithm
pub fn new(m: &'a M) -> Result<Self, Failed> {
if m.shape().0 < 2 {
return Err(Failed::because(
FailedError::FindFailed,
"min number of rows should be 2",
));
}
let mut init = Self {
samples: m,
// to be computed in init(..)
distances: HashMap::with_capacity(m.shape().0),
neighbours: Vec::with_capacity(m.shape().0 + 1),
};
init.init();
Ok(init)
}
/// Initialise `CosinePair` by passing a `Array2`.
/// Build a CosinePairs data-structure from a set of (new) points.
fn init(&mut self) {
// basic measures
let len = self.samples.shape().0;
let max_index = self.samples.shape().0 - 1;
// Store all closest neighbors
let _distances = Box::new(HashMap::with_capacity(len));
let _neighbours = Box::new(Vec::with_capacity(len));
let mut distances = *_distances;
let mut neighbours = *_neighbours;
// fill neighbours with -1 values
neighbours.extend(0..len);
// init closest neighbour pairwise data
for index_row_i in 0..(max_index) {
distances.insert(
index_row_i,
PairwiseDistance {
node: index_row_i,
neighbour: Option::None,
distance: Some(<T as Bounded>::max_value()),
},
);
}
// loop through indeces and neighbours
for index_row_i in 0..(len) {
// start looking for the neighbour in the second element
let mut index_closest = index_row_i + 1; // closest neighbour index
let mut nbd: Option<T> = distances[&index_row_i].distance; // init neighbour distance
for index_row_j in (index_row_i + 1)..len {
distances.insert(
index_row_j,
PairwiseDistance {
node: index_row_j,
neighbour: Some(index_row_i),
distance: nbd,
},
);
let d = Cosine::new().distance(
&Vec::from_iterator(
self.samples.get_row(index_row_i).iterator(0).copied(),
self.samples.shape().1,
),
&Vec::from_iterator(
self.samples.get_row(index_row_j).iterator(0).copied(),
self.samples.shape().1,
),
);
if d < nbd.unwrap().to_f64().unwrap() {
// set this j-value to be the closest neighbour
index_closest = index_row_j;
nbd = Some(T::from(d).unwrap());
}
}
// Add that edge
distances.entry(index_row_i).and_modify(|e| {
e.distance = nbd;
e.neighbour = Some(index_closest);
});
}
// No more neighbors, terminate conga line.
// Last person on the line has no neigbors
distances.get_mut(&max_index).unwrap().neighbour = Some(max_index);
distances.get_mut(&(len - 1)).unwrap().distance = Some(<T as Bounded>::max_value());
// compute sparse matrix (connectivity matrix)
let mut sparse_matrix = M::zeros(len, len);
for (_, p) in distances.iter() {
sparse_matrix.set((p.node, p.neighbour.unwrap()), p.distance.unwrap());
}
self.distances = distances;
self.neighbours = neighbours;
}
/// Query k nearest neighbors for a row that's already in the dataset
pub fn query_row(&self, query_row_index: usize, k: usize) -> Result<Vec<(T, usize)>, Failed> {
if query_row_index >= self.samples.shape().0 {
return Err(Failed::because(
FailedError::FindFailed,
"Query row index out of bounds",
));
}
if k == 0 {
return Ok(Vec::new());
}
// Get distances to all other points
let mut distances = self.distances_from(query_row_index);
// Sort by distance (ascending)
distances.sort_by(|a, b| {
a.distance
.unwrap()
.partial_cmp(&b.distance.unwrap())
.unwrap_or(std::cmp::Ordering::Equal)
});
// Take top k neighbors and convert to (distance, index) format
let neighbors: Vec<(T, usize)> = distances
.into_iter()
.take(k)
.map(|pd| (pd.distance.unwrap(), pd.neighbour.unwrap()))
.collect();
Ok(neighbors)
}
/// Query k nearest neighbors for an external query vector
pub fn query(&self, query_vector: &Vec<T>, k: usize) -> Result<Vec<(T, usize)>, Failed> {
if query_vector.len() != self.samples.shape().1 {
return Err(Failed::because(
FailedError::FindFailed,
"Query vector dimension mismatch",
));
}
if k == 0 {
return Ok(Vec::new());
}
// Compute distances from query vector to all points in the dataset
let mut distances = Vec::<PairwiseDistance<T>>::with_capacity(self.samples.shape().0);
for i in 0..self.samples.shape().0 {
let dataset_point = Vec::from_iterator(
self.samples.get_row(i).iterator(0).copied(),
self.samples.shape().1,
);
let distance = T::from(Cosine::new().distance(query_vector, &dataset_point)).unwrap();
distances.push(PairwiseDistance {
node: i, // This represents the dataset point index
neighbour: Some(i),
distance: Some(distance),
});
}
// Sort by distance (ascending)
distances.sort_by(|a, b| {
a.distance
.unwrap()
.partial_cmp(&b.distance.unwrap())
.unwrap_or(std::cmp::Ordering::Equal)
});
// Take top k neighbors and convert to (distance, index) format
let neighbors: Vec<(T, usize)> = distances
.into_iter()
.take(k)
.map(|pd| (pd.distance.unwrap(), pd.node))
.collect();
Ok(neighbors)
}
/// Optimized version that reuses the existing distances_from method
/// This is more efficient for queries that are points already in the dataset
pub fn query_optimized(
&self,
query_row_index: usize,
k: usize,
) -> Result<Vec<(T, usize)>, Failed> {
// Reuse existing method and sort the results
self.query_row(query_row_index, k)
}
/// Find closest pair by scanning list of nearest neighbors.
#[allow(dead_code)]
pub fn closest_pair(&self) -> PairwiseDistance<T> {
let mut a = self.neighbours[0]; // Start with first point
let mut d = self.distances[&a].distance;
for p in self.neighbours.iter() {
if self.distances[p].distance < d {
a = *p; // Update `a` and distance `d`
d = self.distances[p].distance;
}
}
let b = self.distances[&a].neighbour;
PairwiseDistance {
node: a,
neighbour: b,
distance: d,
}
}
///
/// Return order dissimilarities from closest to furthest
///
#[allow(dead_code)]
pub fn ordered_pairs(&self) -> std::vec::IntoIter<&PairwiseDistance<T>> {
// improvement: implement this to return `impl Iterator<Item = &PairwiseDistance<T>>`
// need to implement trait `Iterator` for `Vec<&PairwiseDistance<T>>`
let mut distances = self
.distances
.values()
.collect::<Vec<&PairwiseDistance<T>>>();
distances.sort_by(|a, b| a.partial_cmp(b).unwrap());
distances.into_iter()
}
//
// Compute distances from input to all other points in data-structure.
// input is the row index of the sample matrix
//
#[allow(dead_code)]
fn distances_from(&self, index_row: usize) -> Vec<PairwiseDistance<T>> {
let mut distances = Vec::<PairwiseDistance<T>>::with_capacity(self.samples.shape().0);
for other in self.neighbours.iter() {
if index_row != *other {
distances.push(PairwiseDistance {
node: index_row,
neighbour: Some(*other),
distance: Some(
T::from(Cosine::new().distance(
&Vec::from_iterator(
self.samples.get_row(index_row).iterator(0).copied(),
self.samples.shape().1,
),
&Vec::from_iterator(
self.samples.get_row(*other).iterator(0).copied(),
self.samples.shape().1,
),
))
.unwrap(),
),
})
}
}
distances
}
}
#[cfg(test)]
mod tests {
use super::*;
use crate::linalg::basic::{arrays::Array, matrix::DenseMatrix};
use approx::assert_relative_eq;
#[cfg_attr(
all(target_arch = "wasm32", not(target_os = "wasi")),
wasm_bindgen_test::wasm_bindgen_test
)]
#[test]
fn cosine_pair_initialization() {
let x = DenseMatrix::<f64>::from_2d_array(&[
&[5.1, 3.5, 1.4, 0.2],
&[4.9, 3.0, 1.4, 0.2],
&[4.7, 3.2, 1.3, 0.2],
&[4.6, 3.1, 1.5, 0.2],
&[5.0, 3.6, 1.4, 0.2],
&[5.4, 3.9, 1.7, 0.4],
])
.unwrap();
let cosine_pair = CosinePair::new(&x);
assert!(cosine_pair.is_ok());
let cp = cosine_pair.unwrap();
assert_eq!(cp.samples.shape().0, 6);
assert_eq!(cp.distances.len(), 6);
assert_eq!(cp.neighbours.len(), 6);
assert!(!cp.distances.is_empty());
assert!(!cp.neighbours.is_empty());
}
#[cfg_attr(
all(target_arch = "wasm32", not(target_os = "wasi")),
wasm_bindgen_test::wasm_bindgen_test
)]
#[test]
fn cosine_pair_minimum_rows_error() {
// Test with only one row - should fail
let x = DenseMatrix::<f64>::from_2d_array(&[&[5.1, 3.5, 1.4, 0.2]]).unwrap();
let result = CosinePair::new(&x);
assert!(result.is_err());
if let Err(e) = result {
let expected_error =
Failed::because(FailedError::FindFailed, "min number of rows should be 2");
assert_eq!(e, expected_error);
}
}
#[cfg_attr(
all(target_arch = "wasm32", not(target_os = "wasi")),
wasm_bindgen_test::wasm_bindgen_test
)]
#[test]
fn cosine_pair_closest_pair() {
let x = DenseMatrix::<f64>::from_2d_array(&[
&[1.0, 0.0],
&[0.0, 1.0],
&[1.0, 1.0],
&[2.0, 2.0], // This should be closest to [1.0, 1.0] with cosine distance
])
.unwrap();
let cosine_pair = CosinePair::new(&x).unwrap();
let closest_pair = cosine_pair.closest_pair();
// Verify structure
assert!(closest_pair.distance.is_some());
assert!(closest_pair.neighbour.is_some());
// The closest pair should have the smallest cosine distance
let distance = closest_pair.distance.unwrap();
assert!(distance >= 0.0 && distance <= 2.0); // Cosine distance range
}
#[cfg_attr(
all(target_arch = "wasm32", not(target_os = "wasi")),
wasm_bindgen_test::wasm_bindgen_test
)]
#[test]
fn cosine_pair_identical_vectors() {
let x = DenseMatrix::<f64>::from_2d_array(&[
&[1.0, 2.0, 3.0],
&[1.0, 2.0, 3.0], // Identical vector
&[4.0, 5.0, 6.0],
])
.unwrap();
let cosine_pair = CosinePair::new(&x).unwrap();
let closest_pair = cosine_pair.closest_pair();
// Distance between identical vectors should be 0
let distance = closest_pair.distance.unwrap();
assert!((distance - 0.0).abs() < 1e-8);
}
#[cfg_attr(
all(target_arch = "wasm32", not(target_os = "wasi")),
wasm_bindgen_test::wasm_bindgen_test
)]
#[test]
fn cosine_pair_orthogonal_vectors() {
let x = DenseMatrix::<f64>::from_2d_array(&[
&[1.0, 0.0],
&[0.0, 1.0], // Orthogonal to first
&[2.0, 3.0],
])
.unwrap();
let cosine_pair = CosinePair::new(&x).unwrap();
// Check that orthogonal vectors have cosine distance of 1.0
let distances_from_first = cosine_pair.distances_from(0);
let orthogonal_distance = distances_from_first
.iter()
.find(|pd| pd.neighbour == Some(1))
.unwrap()
.distance
.unwrap();
assert!((orthogonal_distance - 1.0).abs() < 1e-8);
}
#[cfg_attr(
all(target_arch = "wasm32", not(target_os = "wasi")),
wasm_bindgen_test::wasm_bindgen_test
)]
#[test]
fn cosine_pair_ordered_pairs() {
let x = DenseMatrix::<f64>::from_2d_array(&[
&[1.0, 2.0],
&[2.0, 1.0],
&[3.0, 4.0],
&[4.0, 3.0],
])
.unwrap();
let cosine_pair = CosinePair::new(&x).unwrap();
let ordered_pairs: Vec<_> = cosine_pair.ordered_pairs().collect();
assert_eq!(ordered_pairs.len(), 4);
// Check that pairs are ordered by distance (ascending)
for i in 1..ordered_pairs.len() {
let prev_distance = ordered_pairs[i - 1].distance.unwrap();
let curr_distance = ordered_pairs[i].distance.unwrap();
assert!(prev_distance <= curr_distance);
}
}
#[cfg_attr(
all(target_arch = "wasm32", not(target_os = "wasi")),
wasm_bindgen_test::wasm_bindgen_test
)]
#[test]
fn cosine_pair_query_row() {
let x = DenseMatrix::<f64>::from_2d_array(&[
&[1.0, 0.0, 0.0],
&[0.0, 1.0, 0.0],
&[0.0, 0.0, 1.0],
&[1.0, 1.0, 0.0],
&[0.0, 1.0, 1.0],
])
.unwrap();
let cosine_pair = CosinePair::new(&x).unwrap();
// Query k=2 nearest neighbors for row 0
let neighbors = cosine_pair.query_row(0, 2).unwrap();
assert_eq!(neighbors.len(), 2);
// Check that distances are in ascending order
assert!(neighbors[0].0 <= neighbors[1].0);
// All distances should be valid cosine distances (0 to 2)
for (distance, _) in &neighbors {
assert!(*distance >= 0.0 && *distance <= 2.0);
}
}
#[cfg_attr(
all(target_arch = "wasm32", not(target_os = "wasi")),
wasm_bindgen_test::wasm_bindgen_test
)]
#[test]
fn cosine_pair_query_row_bounds_error() {
let x = DenseMatrix::<f64>::from_2d_array(&[&[1.0, 2.0], &[3.0, 4.0]]).unwrap();
let cosine_pair = CosinePair::new(&x).unwrap();
// Query with out-of-bounds row index
let result = cosine_pair.query_row(5, 1);
assert!(result.is_err());
if let Err(e) = result {
let expected_error =
Failed::because(FailedError::FindFailed, "Query row index out of bounds");
assert_eq!(e, expected_error);
}
}
#[cfg_attr(
all(target_arch = "wasm32", not(target_os = "wasi")),
wasm_bindgen_test::wasm_bindgen_test
)]
#[test]
fn cosine_pair_query_row_k_zero() {
let x =
DenseMatrix::<f64>::from_2d_array(&[&[1.0, 2.0], &[3.0, 4.0], &[5.0, 6.0]]).unwrap();
let cosine_pair = CosinePair::new(&x).unwrap();
let neighbors = cosine_pair.query_row(0, 0).unwrap();
assert_eq!(neighbors.len(), 0);
}
#[cfg_attr(
all(target_arch = "wasm32", not(target_os = "wasi")),
wasm_bindgen_test::wasm_bindgen_test
)]
#[test]
fn cosine_pair_query_external_vector() {
let x = DenseMatrix::<f64>::from_2d_array(&[
&[1.0, 0.0, 0.0],
&[0.0, 1.0, 0.0],
&[0.0, 0.0, 1.0],
&[1.0, 1.0, 0.0],
])
.unwrap();
let cosine_pair = CosinePair::new(&x).unwrap();
// Query with external vector
let query_vector = vec![1.0, 0.5, 0.0];
let neighbors = cosine_pair.query(&query_vector, 2).unwrap();
assert_eq!(neighbors.len(), 2);
// Verify distances are valid and ordered
assert!(neighbors[0].0 <= neighbors[1].0);
for (distance, index) in &neighbors {
assert!(*distance >= 0.0 && *distance <= 2.0);
assert!(*index < x.shape().0);
}
}
#[test]
fn cosine_pair_query_dimension_mismatch() {
let x = DenseMatrix::<f64>::from_2d_array(&[&[1.0, 2.0, 3.0], &[4.0, 5.0, 6.0]]).unwrap();
let cosine_pair = CosinePair::new(&x).unwrap();
// Query with mismatched dimensions
let query_vector = vec![1.0, 2.0]; // Only 2 dimensions, but data has 3
let result = cosine_pair.query(&query_vector, 1);
assert!(result.is_err());
if let Err(e) = result {
let expected_error =
Failed::because(FailedError::FindFailed, "Query vector dimension mismatch");
assert_eq!(e, expected_error);
}
}
#[cfg_attr(
all(target_arch = "wasm32", not(target_os = "wasi")),
wasm_bindgen_test::wasm_bindgen_test
)]
#[test]
fn cosine_pair_query_k_zero_external() {
let x = DenseMatrix::<f64>::from_2d_array(&[&[1.0, 2.0], &[3.0, 4.0]]).unwrap();
let cosine_pair = CosinePair::new(&x).unwrap();
let query_vector = vec![1.0, 1.0];
let neighbors = cosine_pair.query(&query_vector, 0).unwrap();
assert_eq!(neighbors.len(), 0);
}
#[test]
fn cosine_pair_large_dataset() {
// Test with larger dataset (similar to Iris)
let x = DenseMatrix::<f64>::from_2d_array(&[
&[5.1, 3.5, 1.4, 0.2],
&[4.9, 3.0, 1.4, 0.2],
&[4.7, 3.2, 1.3, 0.2],
&[4.6, 3.1, 1.5, 0.2],
&[5.0, 3.6, 1.4, 0.2],
&[5.4, 3.9, 1.7, 0.4],
&[4.6, 3.4, 1.4, 0.3],
&[5.0, 3.4, 1.5, 0.2],
&[4.4, 2.9, 1.4, 0.2],
&[4.9, 3.1, 1.5, 0.1],
&[7.0, 3.2, 4.7, 1.4],
&[6.4, 3.2, 4.5, 1.5],
&[6.9, 3.1, 4.9, 1.5],
&[5.5, 2.3, 4.0, 1.3],
&[6.5, 2.8, 4.6, 1.5],
])
.unwrap();
let cosine_pair = CosinePair::new(&x).unwrap();
assert_eq!(cosine_pair.samples.shape().0, 15);
assert_eq!(cosine_pair.distances.len(), 15);
assert_eq!(cosine_pair.neighbours.len(), 15);
// Test closest pair computation
let closest_pair = cosine_pair.closest_pair();
assert!(closest_pair.distance.is_some());
assert!(closest_pair.neighbour.is_some());
let distance = closest_pair.distance.unwrap();
assert!(distance >= 0.0 && distance <= 2.0);
}
#[test]
fn cosine_pair_float_precision() {
// Test with f32 precision
let x = DenseMatrix::<f32>::from_2d_array(&[
&[1.0f32, 2.0, 3.0],
&[4.0f32, 5.0, 6.0],
&[7.0f32, 8.0, 9.0],
])
.unwrap();
let cosine_pair = CosinePair::new(&x).unwrap();
let closest_pair = cosine_pair.closest_pair();
assert!(closest_pair.distance.is_some());
let distance = closest_pair.distance.unwrap();
assert!(distance >= 0.0 && distance <= 2.0);
// Test querying
let neighbors = cosine_pair.query_row(0, 2).unwrap();
assert_eq!(neighbors.len(), 2);
assert_eq!(neighbors[0].1, 1);
assert_relative_eq!(neighbors[0].0, 0.025368154);
assert_eq!(neighbors[1].1, 2);
assert_relative_eq!(neighbors[1].0, 0.040588055);
}
#[cfg_attr(
all(target_arch = "wasm32", not(target_os = "wasi")),
wasm_bindgen_test::wasm_bindgen_test
)]
#[test]
fn cosine_pair_distances_from() {
let x = DenseMatrix::<f64>::from_2d_array(&[
&[1.0, 0.0],
&[0.0, 1.0],
&[1.0, 1.0],
&[2.0, 0.0],
])
.unwrap();
let cosine_pair = CosinePair::new(&x).unwrap();
let distances = cosine_pair.distances_from(0);
// Should have 3 distances (excluding self)
assert_eq!(distances.len(), 3);
// All should be from node 0
for pd in &distances {
assert_eq!(pd.node, 0);
assert!(pd.neighbour.is_some());
assert!(pd.distance.is_some());
assert!(pd.neighbour.unwrap() != 0); // Should not include self
}
}
#[cfg_attr(
all(target_arch = "wasm32", not(target_os = "wasi")),
wasm_bindgen_test::wasm_bindgen_test
)]
#[test]
fn cosine_pair_consistency_check() {
// Verify that different query methods return consistent results
let x = DenseMatrix::<f64>::from_2d_array(&[
&[1.0, 2.0, 3.0],
&[4.0, 5.0, 6.0],
&[7.0, 8.0, 9.0],
&[2.0, 3.0, 4.0],
])
.unwrap();
let cosine_pair = CosinePair::new(&x).unwrap();
// Query row 0 using internal method
let neighbors_internal = cosine_pair.query_row(0, 2).unwrap();
// Query row 0 using optimized method (should be same)
let neighbors_optimized = cosine_pair.query_optimized(0, 2).unwrap();
assert_eq!(neighbors_internal.len(), neighbors_optimized.len());
for i in 0..neighbors_internal.len() {
let (dist1, idx1) = neighbors_internal[i];
let (dist2, idx2) = neighbors_optimized[i];
assert!((dist1 - dist2).abs() < 1e-10);
assert_eq!(idx1, idx2);
}
}
// Brute force algorithm for testing/comparison
fn closest_pair_brute_force(
cosine_pair: &CosinePair<'_, f64, DenseMatrix<f64>>,
) -> PairwiseDistance<f64> {
use itertools::Itertools;
let m = cosine_pair.samples.shape().0;
let mut closest_pair = PairwiseDistance {
node: 0,
neighbour: None,
distance: Some(f64::MAX),
};
for pair in (0..m).combinations(2) {
let d = Cosine::new().distance(
&Vec::from_iterator(
cosine_pair.samples.get_row(pair[0]).iterator(0).copied(),
cosine_pair.samples.shape().1,
),
&Vec::from_iterator(
cosine_pair.samples.get_row(pair[1]).iterator(0).copied(),
cosine_pair.samples.shape().1,
),
);
if d < closest_pair.distance.unwrap() {
closest_pair.node = pair[0];
closest_pair.neighbour = Some(pair[1]);
closest_pair.distance = Some(d);
}
}
closest_pair
}
#[test]
fn cosine_pair_vs_brute_force() {
let x = DenseMatrix::<f64>::from_2d_array(&[
&[1.0, 2.0, 3.0],
&[4.0, 5.0, 6.0],
&[7.0, 8.0, 9.0],
&[1.1, 2.1, 3.1], // Close to first point
])
.unwrap();
let cosine_pair = CosinePair::new(&x).unwrap();
let cp_result = cosine_pair.closest_pair();
let brute_result = closest_pair_brute_force(&cosine_pair);
// Results should be identical or very close
assert!((cp_result.distance.unwrap() - brute_result.distance.unwrap()).abs() < 1e-10);
}
}
+2
View File
@@ -39,6 +39,8 @@ use crate::numbers::basenum::Number;
use serde::{Deserialize, Serialize}; use serde::{Deserialize, Serialize};
pub(crate) mod bbd_tree; pub(crate) mod bbd_tree;
/// a variant of fastpair using cosine distance
pub mod cosinepair;
/// tree data structure for fast nearest neighbor search /// tree data structure for fast nearest neighbor search
pub mod cover_tree; pub mod cover_tree;
/// fastpair closest neighbour algorithm /// fastpair closest neighbour algorithm
+1
View File
@@ -1,6 +1,7 @@
use num_traits::Num; use num_traits::Num;
pub trait QuickArgSort { pub trait QuickArgSort {
#[allow(dead_code)]
fn quick_argsort_mut(&mut self) -> Vec<usize>; fn quick_argsort_mut(&mut self) -> Vec<usize>;
#[allow(dead_code)] #[allow(dead_code)]
+219
View File
@@ -0,0 +1,219 @@
//! # Cosine Distance Metric
//!
//! The cosine distance between two points \\( x \\) and \\( y \\) in n-space is defined as:
//!
//! \\[ d(x, y) = 1 - \frac{x \cdot y}{||x|| ||y||} \\]
//!
//! where \\( x \cdot y \\) is the dot product of the vectors, and \\( ||x|| \\) and \\( ||y|| \\)
//! are their respective magnitudes (Euclidean norms).
//!
//! Cosine distance measures the angular dissimilarity between vectors, ranging from 0 to 2.
//! A value of 0 indicates identical direction (parallel vectors), while larger values indicate
//! greater angular separation.
//!
//! Example:
//!
//! ```
//! use smartcore::metrics::distance::Distance;
//! use smartcore::metrics::distance::cosine::Cosine;
//!
//! let x = vec![1., 1.];
//! let y = vec![2., 2.];
//!
//! let cosine_dist: f64 = Cosine::new().distance(&x, &y);
//! ```
//!
//! <script src="https://polyfill.io/v3/polyfill.min.js?features=es6"></script>
//! <script id="MathJax-script" async src="https://cdn.jsdelivr.net/npm/mathjax@3/es5/tex-mml-chtml.js"></script>
#[cfg(feature = "serde")]
use serde::{Deserialize, Serialize};
use std::marker::PhantomData;
use crate::linalg::basic::arrays::ArrayView1;
use crate::numbers::basenum::Number;
use super::Distance;
/// Cosine distance is a measure of the angular dissimilarity between two non-zero vectors in n-space.
/// It is defined as 1 minus the cosine similarity of the vectors.
#[cfg_attr(feature = "serde", derive(Serialize, Deserialize))]
#[derive(Debug, Clone)]
pub struct Cosine<T> {
_t: PhantomData<T>,
}
impl<T: Number> Default for Cosine<T> {
fn default() -> Self {
Self::new()
}
}
impl<T: Number> Cosine<T> {
/// Instantiate the initial structure
pub fn new() -> Cosine<T> {
Cosine { _t: PhantomData }
}
/// Calculate the dot product of two vectors using smartcore's ArrayView1 trait
#[inline]
pub(crate) fn dot_product<A: ArrayView1<T>>(x: &A, y: &A) -> f64 {
if x.shape() != y.shape() {
panic!("Input vector sizes are different.");
}
// Use the built-in dot product method from ArrayView1 trait
x.dot(y).to_f64().unwrap()
}
/// Calculate the squared magnitude (norm squared) of a vector
#[inline]
#[allow(dead_code)]
pub(crate) fn squared_magnitude<A: ArrayView1<T>>(x: &A) -> f64 {
x.iterator(0)
.map(|&a| {
let val = a.to_f64().unwrap();
val * val
})
.sum()
}
/// Calculate the magnitude (Euclidean norm) of a vector using smartcore's norm2 method
#[inline]
pub(crate) fn magnitude<A: ArrayView1<T>>(x: &A) -> f64 {
// Use the built-in norm2 method from ArrayView1 trait
x.norm2()
}
/// Calculate cosine similarity between two vectors
#[inline]
pub(crate) fn cosine_similarity<A: ArrayView1<T>>(x: &A, y: &A) -> f64 {
let dot_product = Self::dot_product(x, y);
let magnitude_x = Self::magnitude(x);
let magnitude_y = Self::magnitude(y);
if magnitude_x == 0.0 || magnitude_y == 0.0 {
panic!("Cannot compute cosine distance for zero-magnitude vectors.");
}
dot_product / (magnitude_x * magnitude_y)
}
}
impl<T: Number, A: ArrayView1<T>> Distance<A> for Cosine<T> {
fn distance(&self, x: &A, y: &A) -> f64 {
let similarity = Cosine::cosine_similarity(x, y);
1.0 - similarity
}
}
#[cfg(test)]
mod tests {
use super::*;
#[cfg_attr(
all(target_arch = "wasm32", not(target_os = "wasi")),
wasm_bindgen_test::wasm_bindgen_test
)]
#[test]
fn cosine_distance_identical_vectors() {
let a = vec![1, 2, 3];
let b = vec![1, 2, 3];
let dist: f64 = Cosine::new().distance(&a, &b);
assert!((dist - 0.0).abs() < 1e-8);
}
#[cfg_attr(
all(target_arch = "wasm32", not(target_os = "wasi")),
wasm_bindgen_test::wasm_bindgen_test
)]
#[test]
fn cosine_distance_orthogonal_vectors() {
let a = vec![1, 0];
let b = vec![0, 1];
let dist: f64 = Cosine::new().distance(&a, &b);
assert!((dist - 1.0).abs() < 1e-8);
}
#[cfg_attr(
all(target_arch = "wasm32", not(target_os = "wasi")),
wasm_bindgen_test::wasm_bindgen_test
)]
#[test]
fn cosine_distance_opposite_vectors() {
let a = vec![1, 2, 3];
let b = vec![-1, -2, -3];
let dist: f64 = Cosine::new().distance(&a, &b);
assert!((dist - 2.0).abs() < 1e-8);
}
#[cfg_attr(
all(target_arch = "wasm32", not(target_os = "wasi")),
wasm_bindgen_test::wasm_bindgen_test
)]
#[test]
fn cosine_distance_general_case() {
let a = vec![1.0, 2.0, 3.0];
let b = vec![2.0, 1.0, 3.0];
let dist: f64 = Cosine::new().distance(&a, &b);
// Expected cosine similarity: (1*2 + 2*1 + 3*3) / (sqrt(1+4+9) * sqrt(4+1+9))
// = (2 + 2 + 9) / (sqrt(14) * sqrt(14)) = 13/14 ≈ 0.9286
// So cosine distance = 1 - 13/14 = 1/14 ≈ 0.0714
let expected_dist = 1.0 - (13.0 / 14.0);
assert!((dist - expected_dist).abs() < 1e-8);
}
#[cfg_attr(
all(target_arch = "wasm32", not(target_os = "wasi")),
wasm_bindgen_test::wasm_bindgen_test
)]
#[test]
#[should_panic(expected = "Input vector sizes are different.")]
fn cosine_distance_different_sizes() {
let a = vec![1, 2];
let b = vec![1, 2, 3];
let _dist: f64 = Cosine::new().distance(&a, &b);
}
#[cfg_attr(
all(target_arch = "wasm32", not(target_os = "wasi")),
wasm_bindgen_test::wasm_bindgen_test
)]
#[test]
#[should_panic(expected = "Cannot compute cosine distance for zero-magnitude vectors.")]
fn cosine_distance_zero_vector() {
let a = vec![0, 0, 0];
let b = vec![1, 2, 3];
let _dist: f64 = Cosine::new().distance(&a, &b);
}
#[cfg_attr(
all(target_arch = "wasm32", not(target_os = "wasi")),
wasm_bindgen_test::wasm_bindgen_test
)]
#[test]
fn cosine_distance_float_precision() {
let a = vec![1.0f32, 2.0, 3.0];
let b = vec![4.0f32, 5.0, 6.0];
let dist: f64 = Cosine::new().distance(&a, &b);
// Calculate expected value manually
let dot_product = 1.0 * 4.0 + 2.0 * 5.0 + 3.0 * 6.0; // = 32
let mag_a = (1.0 * 1.0 + 2.0 * 2.0 + 3.0 * 3.0_f64).sqrt(); // = sqrt(14)
let mag_b = (4.0 * 4.0 + 5.0 * 5.0 + 6.0 * 6.0_f64).sqrt(); // = sqrt(77)
let expected_similarity = dot_product / (mag_a * mag_b);
let expected_distance = 1.0 - expected_similarity;
assert!((dist - expected_distance).abs() < 1e-6);
}
}
+2
View File
@@ -13,6 +13,8 @@
//! <script src="https://polyfill.io/v3/polyfill.min.js?features=es6"></script> //! <script src="https://polyfill.io/v3/polyfill.min.js?features=es6"></script>
//! <script id="MathJax-script" async src="https://cdn.jsdelivr.net/npm/mathjax@3/es5/tex-mml-chtml.js"></script> //! <script id="MathJax-script" async src="https://cdn.jsdelivr.net/npm/mathjax@3/es5/tex-mml-chtml.js"></script>
/// Cosine distance
pub mod cosine;
/// Euclidean Distance is the straight-line distance between two points in Euclidean spacere that presents the shortest distance between these points. /// Euclidean Distance is the straight-line distance between two points in Euclidean spacere that presents the shortest distance between these points.
pub mod euclidian; pub mod euclidian;
/// Hamming Distance between two strings is the number of positions at which the corresponding symbols are different. /// Hamming Distance between two strings is the number of positions at which the corresponding symbols are different.
+4 -4
View File
@@ -6,8 +6,8 @@ pub trait LineSearchMethod<T: Float> {
/// Find alpha that satisfies strong Wolfe conditions. /// Find alpha that satisfies strong Wolfe conditions.
fn search( fn search(
&self, &self,
f: &(dyn Fn(T) -> T), f: &dyn Fn(T) -> T,
df: &(dyn Fn(T) -> T), df: &dyn Fn(T) -> T,
alpha: T, alpha: T,
f0: T, f0: T,
df0: T, df0: T,
@@ -55,8 +55,8 @@ impl<T: Float> Default for Backtracking<T> {
impl<T: Float> LineSearchMethod<T> for Backtracking<T> { impl<T: Float> LineSearchMethod<T> for Backtracking<T> {
fn search( fn search(
&self, &self,
f: &(dyn Fn(T) -> T), f: &dyn Fn(T) -> T,
_: &(dyn Fn(T) -> T), _: &dyn Fn(T) -> T,
alpha: T, alpha: T,
f0: T, f0: T,
df0: T, df0: T,
+11 -6
View File
@@ -674,15 +674,20 @@ impl<TX: Number + PartialOrd, TY: Number + Ord, X: Array2<TX>, Y: Array1<TY>>
) -> bool { ) -> bool {
let (n_rows, n_attr) = visitor.x.shape(); let (n_rows, n_attr) = visitor.x.shape();
let mut label = Option::None; let mut label = None;
let mut is_pure = true; let mut is_pure = true;
for i in 0..n_rows { for i in 0..n_rows {
if visitor.samples[i] > 0 { if visitor.samples[i] > 0 {
if label.is_none() { match label {
label = Option::Some(visitor.y[i]); None => {
} else if visitor.y[i] != label.unwrap() { label = Some(visitor.y[i]);
is_pure = false; }
break; Some(current_label) => {
if visitor.y[i] != current_label {
is_pure = false;
break;
}
}
} }
} }
} }
+1 -1
View File
@@ -96,7 +96,7 @@ impl Objective {
pub fn gradient<TY: Number, Y: Array1<TY>>(&self, y_true: &Y, y_pred: &Vec<f64>) -> Vec<f64> { pub fn gradient<TY: Number, Y: Array1<TY>>(&self, y_true: &Y, y_pred: &Vec<f64>) -> Vec<f64> {
match self { match self {
Objective::MeanSquaredError => zip(y_true.iterator(0), y_pred) Objective::MeanSquaredError => zip(y_true.iterator(0), y_pred)
.map(|(true_val, pred_val)| (*pred_val - true_val.to_f64().unwrap())) .map(|(true_val, pred_val)| *pred_val - true_val.to_f64().unwrap())
.collect(), .collect(),
} }
} }