nmr-processing - npm Package Compare versions

Comparing version 1.0.0 to 1.0.1

CHANGELOG.md

 # Changelog
 
+### [1.0.1](https://www.github.com/cheminfo/nmr-processing/compare/v1.0.0...v1.0.1) (2021-03-24)
+
+
+### Bug Fixes
+
+* update ml-matrix-peaks-finder to v1.0.0 ([da734cc](https://www.github.com/cheminfo/nmr-processing/commit/da734cc91928750ca2038ff285f8d2db65130284))
+
 ## [1.0.0](https://www.github.com/cheminfo/nmr-processing/compare/v0.14.0...v1.0.0) (2021-03-24)
@@ -4,0 +11,0 @@

package.json

 {
   "name": "nmr-processing",
-  "version": "1.0.0",
+  "version": "1.0.1",
   "description": "",
@@ -67,3 +67,3 @@ "main": "lib/index.js",
     "ml-matrix-convolution": "^1.0.0",
-    "ml-matrix-peaks-finder": "^0.4.0",
+    "ml-matrix-peaks-finder": "^1.0.0",
     "ml-peak-shape-generator": "^1.0.0",
@@ -70,0 +70,0 @@ "ml-simple-clustering": "^0.1.0",

README.md

@@ -0,0 +0,0 @@ # nmr-processing

src/constants/couplingPatterns.js

@@ -0,0 +0,0 @@ export const couplingPatterns = [

src/constants/gyromagneticRatio.js

@@ -0,0 +0,0 @@ // sources:

src/constants/impurities.js

@@ -0,0 +0,0 @@ /* eslint-disable camelcase */

src/index.js

@@ -0,0 +0,0 @@ /**

src/peaks/peaksFilterImpurities.js

@@ -0,0 +0,0 @@ import { impurities } from '../constants/impurities';

src/peaks/peaksToRanges.js

@@ -0,0 +0,0 @@ // import { Ranges } from 'spectra-data-ranges';

src/peaks/util/determineRealTop.js

@@ -0,0 +0,0 @@ import LM from 'ml-levenberg-marquardt';

src/peaks/util/getKernel.js

@@ -0,0 +0,0 @@ export function getKernel(options = {}) {

src/peaks/util/jAnalyzer.js

@@ -0,0 +0,0 @@ /*

src/peaks/util/joinRanges.js

@@ -0,0 +0,0 @@ export function joinRanges(ranges) {

src/peaks/util/peakOptimizer.js

@@ -0,0 +0,0 @@ let diagonalError = 0.05;

src/prediction/predictionProton.js

@@ -0,0 +0,0 @@ import FormData from 'form-data';

src/ranges/rangesToACS.js

@@ -0,0 +0,0 @@ import { signalJoinCouplings } from '../signal/signalJoinCouplings';

src/signal/signalJoinCouplings.js

@@ -0,0 +0,0 @@ import { couplingPatterns } from '../constants/couplingPatterns';

src/signal/signalMultiplicityPattern.js

@@ -0,0 +0,0 @@ /**

src/signals/signalsToRanges.js

@@ -0,0 +0,0 @@ export function signalsToRanges(signals, options = {}) {

src/signals/signalsToXY.js

@@ -0,0 +0,0 @@ import rescale from 'ml-array-rescale';

src/signals/simulation/ensureClusterSize.js

@@ -0,0 +0,0 @@ import isAnyArray from 'is-any-array';

src/signals/simulation/getPauliMatrix.js

@@ -0,0 +0,0 @@ import { SparseMatrix } from 'ml-sparse-matrix';

src/signals/simulation/signalsToSpinSystem.js

@@ -0,0 +0,0 @@ import Matrix from 'ml-matrix';

src/signals/simulation/simulate1D.js

@@ -0,0 +0,0 @@ import binarySearch from 'binary-search';

src/xy/xyAutoPeaksPicking.js

@@ -0,0 +0,0 @@ import { gsd, joinBroadPeaks, optimizePeaks } from 'ml-gsd';

src/xy/xyAutoRangesPicking.js

@@ -0,0 +0,0 @@ import { peaksFilterImpurities } from '../peaks/peaksFilterImpurities';

src/xyz/xyzAutoPeaksPicking.js

@@ -0,0 +0,0 @@ import { Matrix } from 'ml-matrix';

src/xyz/xyzJResAnalyzer.js

@@ -0,0 +0,0 @@ import assignDeep from 'assign-deep';

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Improved metrics

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329303

increased by4.02%

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3

increased by50%

Dependency changes

• + Addedml-matrix-peaks-finder@1.0.0(transitive)

• - Removedml-matrix-convolution@0.5.2(transitive)

• - Removedml-matrix-peaks-finder@0.4.0(transitive)

• - Removedml-stat@1.3.3(transitive)

• Updatedml-matrix-peaks-finder@^1.0.0