nmr-processing 18.0.0 → 18.0.1
This diff represents the content of publicly available package versions that have been released to one of the supported registries. The information contained in this diff is provided for informational purposes only and reflects changes between package versions as they appear in their respective public registries.
- package/CHANGELOG.md +1805 -0
- package/nmr-processing.d.ts +2 -1
- package/package.json +8 -8
package/nmr-processing.d.ts
CHANGED
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@@ -40,6 +40,7 @@ import type { Shape1D } from 'ml-peak-shape-generator';
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import { SpectraDataWithIds as SpectraDataWithIds_2 } from './nmrAssigment';
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import type { TopicMolecule } from 'openchemlib-utils';
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import type { XDistributionStats } from 'ml-spectra-processing';
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import type { XRobustDistributionStats } from 'ml-spectra-processing';
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import type { XYEquallySpacedOptions } from 'ml-spectra-processing';
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import type { XYNumber } from 'spectrum-generator';
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@@ -1341,7 +1342,7 @@ export declare interface NMRSignal1D {
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}
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export declare type NMRSignal1DFromPrediction = MakeMandatory<NMRSignal1D, 'nbAtoms' | 'atoms' | 'diaIDs'> & {
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statistics?:
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statistics?: XRobustDistributionStats;
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metadata?: HOSEPrediction;
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};
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package/package.json
CHANGED
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@@ -1,6 +1,6 @@
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{
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"name": "nmr-processing",
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"version": "18.0.
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"version": "18.0.1",
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"description": "Pure functions allowing to process NMR spectra.",
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"license": "CC-BY-NC-SA-4.0",
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"keywords": [],
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@@ -25,7 +25,7 @@
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"scripts": {
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"api-extractor": "api-extractor run --local",
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"build": "tsc --project tsconfig.cheminfo-build.json && cheminfo-build --entry lib/index.js --no-source-map && rm dist/nmr-processing.js",
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"bundle": "npm run bundle-cjs && npm run bundle-esm",
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"bundle": "npm run bundle-cjs && npm run bundle-esm && npm run bundle-types",
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"bundle-common": "esbuild src/index.ts --bundle --packages=external --minify",
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"bundle-cjs": "npm run bundle-common -- --format=cjs --outfile=nmr-processing.cjs",
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"bundle-esm": "npm run bundle-common -- --format=esm --outfile=nmr-processing.mjs",
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@@ -34,7 +34,7 @@
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"check-types": "tsc --noEmit",
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"eslint": "eslint scripts src test --cache",
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"eslint-fix": "npm run eslint -- --fix",
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"prepack": "npm run bundle
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"prepack": "npm run bundle",
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"prettier": "prettier --check scripts src test",
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"prettier-write": "prettier --write scripts src test",
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"test": "npm run test-only && npm run check-types && npm run eslint && npm run prettier",
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@@ -63,7 +63,7 @@
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"jest-matcher-deep-close-to": "^3.0.2",
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"nmr-load-save": "^3.4.0",
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"nmr-xy-testdata": "^0.5.1",
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"openchemlib": "^9.0.
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"openchemlib": "^9.0.1",
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"prettier": "^3.5.3",
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"rimraf": "^6.0.1",
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"typescript": "~5.8.3",
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@@ -75,7 +75,7 @@
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"@types/d3-color": "^3.1.3",
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"@types/d3-interpolate": "^3.0.4",
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"binary-search": "^1.3.6",
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"d3-color": "
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"d3-color": "3.1.0",
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"d3-interpolate": "^2.0.1",
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"gyromagnetic-ratio": "^1.2.1",
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"is-any-array": "^2.0.1",
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@@ -98,12 +98,12 @@
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"ml-signal-processing": "^1.2.0",
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"ml-simple-clustering": "^0.1.0",
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"ml-sparse-matrix": "^2.1.0",
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"ml-spectra-processing": "^14.
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"ml-spectra-processing": "^14.12.0",
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"ml-tree-set": "^0.1.1",
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"multiplet-analysis": "^2.1.5",
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"nmr-correlation": "^2.3.5",
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"numeral": "^2.0.6",
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"openchemlib-utils": "^
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"openchemlib-utils": "^8.1.0",
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"spectrum-generator": "^8.1.0"
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}
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}
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}
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