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6 changes: 3 additions & 3 deletions package.json
Original file line number Diff line number Diff line change
Expand Up @@ -40,8 +40,8 @@
"devDependencies": {
"@vitest/coverage-v8": "^3.2.4",
"@zakodium/tsconfig": "^1.0.2",
"eslint": "^9.33.0",
"eslint-config-cheminfo-typescript": "^19.0.0",
"eslint": "^9.35.0",
"eslint-config-cheminfo-typescript": "^20.0.0",
"jest-matcher-deep-close-to": "^3.0.2",
"prettier": "^3.6.2",
"rimraf": "^6.0.1",
Expand All @@ -54,6 +54,6 @@
"cheminfo-types": "^1.8.1",
"ml-gsd": "^13.0.1",
"ml-savitzky-golay-generalized": "^4.2.0",
"ml-spectra-processing": "^14.17.0"
"ml-spectra-processing": "^14.17.1"
}
}
101 changes: 65 additions & 36 deletions src/__tests__/filterXY.test.ts
Original file line number Diff line number Diff line change
@@ -1,49 +1,78 @@
import { describe, expect, it } from 'vitest';
import { expect, test } from 'vitest';

import type { FilterXYType } from '../FilterXYType.ts';
import linear from '../filters/__tests__/data/linear.ts';
import { filterXY } from '../index.ts';

describe('filterXY', () => {
it('filters', () => {
const filters: FilterXYType[] = [
{ name: 'centerMedian' },
{ name: 'fromTo', options: { from: 2, to: 8 } },
];
test('filters', () => {
const filters: FilterXYType[] = [
{ name: 'centerMedian' },
{ name: 'fromTo', options: { from: 2, to: 8 } },
];

const result = filterXY(linear, filters);
const result = filterXY(linear, filters);

expect(result.data).toStrictEqual({
x: Float64Array.from([2, 3, 4, 5, 6, 7, 8]),
y: Float64Array.from([-1, 0, 1, 2, 1, 0, -1]),
});
expect(result.data).toStrictEqual({
x: Float64Array.from([2, 3, 4, 5, 6, 7, 8]),
y: Float64Array.from([-1, 0, 1, 2, 1, 0, -1]),
});
});

test('reverseIfNeeded, not needed', () => {
const filters: FilterXYType[] = [{ name: 'reverseIfNeeded' }];
const data = {
x: Float64Array.from([1, 2, 3, 4, 5]),
y: Float64Array.from([1, 2, 3, 4, 1]),
};
const result = filterXY(data, filters);

it('reverseIfNeeded, not needed', () => {
const filters: FilterXYType[] = [{ name: 'reverseIfNeeded' }];
const data = {
x: Float64Array.from([1, 2, 3, 4, 5]),
y: Float64Array.from([1, 2, 3, 4, 1]),
};
const result = filterXY(data, filters);

expect(result.data).toStrictEqual({
x: Float64Array.from([1, 2, 3, 4, 5]),
y: Float64Array.from([1, 2, 3, 4, 1]),
});
expect(result.data).toStrictEqual({
x: Float64Array.from([1, 2, 3, 4, 5]),
y: Float64Array.from([1, 2, 3, 4, 1]),
});
});

it('reverseIfNeeded, needed', () => {
const filters: FilterXYType[] = [{ name: 'reverseIfNeeded' }];
const data = {
x: Float64Array.from([5, 4, 3, 2, 1]),
y: Float64Array.from([1, 2, 3, 4, 1]),
};
const result = filterXY(data, filters);

expect(result.data).toStrictEqual({
x: Float64Array.from([1, 2, 3, 4, 5]),
y: Float64Array.from([1, 4, 3, 2, 1]),
});
test('reverseIfNeeded, needed', () => {
const filters: FilterXYType[] = [{ name: 'reverseIfNeeded' }];
const data = {
x: Float64Array.from([5, 4, 3, 2, 1]),
y: Float64Array.from([1, 2, 3, 4, 1]),
};
const result = filterXY(data, filters);

expect(result.data).toStrictEqual({
x: Float64Array.from([1, 2, 3, 4, 5]),
y: Float64Array.from([1, 4, 3, 2, 1]),
});
});

test('reverseIfNeeded, with empty filter', () => {
const filters: FilterXYType[] = [
// @ts-expect-error testing empty filter
{ name: '' },
// @ts-expect-error testing empty filter
{},
{ name: 'reverseIfNeeded' },
];
const data = {
x: Float64Array.from([5, 4, 3, 2, 1]),
y: Float64Array.from([1, 2, 3, 4, 1]),
};
const result = filterXY(data, filters);

expect(result.data).toStrictEqual({
x: Float64Array.from([1, 2, 3, 4, 5]),
y: Float64Array.from([1, 4, 3, 2, 1]),
});
});

test('unknown filter', () => {
// @ts-expect-error testing error
const filters: FilterXYType[] = [{ name: 'abc' }];
const data = {
x: Float64Array.from([5, 4, 3, 2, 1]),
y: Float64Array.from([1, 2, 3, 4, 1]),
};

expect(() => filterXY(data, filters)).toThrow('Unknown filter: abc');
});
5 changes: 5 additions & 0 deletions src/filterXY.ts
Original file line number Diff line number Diff line change
Expand Up @@ -6,8 +6,8 @@

/**
* Apply filters on {x:[], y:[]}
* @param data

Check warning on line 9 in src/filterXY.ts

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Missing JSDoc @param "data" description
* @param filters

Check warning on line 10 in src/filterXY.ts

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GitHub Actions / nodejs / lint-eslint

Missing JSDoc @param "filters" description
* @returns A very important number
*/
export function filterXY(data: DataXY, filters: FilterXYType[]) {
Expand All @@ -20,6 +20,11 @@
for (const filter of filters) {
const start = Date.now();

if (!filter.name) {
// we ignore empty filter names
continue;
}

const filterFct = Filters[filter.name];
if (!filterFct) {
throw new Error(`Unknown filter: ${filter.name}`);
Expand Down
8 changes: 4 additions & 4 deletions src/filters/x/calibrateX.ts
Original file line number Diff line number Diff line change
Expand Up @@ -63,15 +63,15 @@ export function calibrateX(
const fromIndex = xFindClosestIndex(data.x, from);
const toIndex = xFindClosestIndex(data.x, to);

const peaks = gsd(
let peaks = gsd(
{
x: data.x.subarray(fromIndex, toIndex),
y: data.y.subarray(fromIndex, toIndex),
},
gsdOptions,
)
.sort((a, b) => b.y - a.y)
.slice(0, nbPeaks);
);
peaks.sort((a, b) => b.y - a.y);
peaks = peaks.slice(0, nbPeaks);

if (peaks.length < nbPeaks) return { data };

Expand Down
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