nmr-processing - npm Package Compare versions

Comparing version 1.5.0 to 1.5.1

CHANGELOG.md

 # Changelog
 
+### [1.5.1](https://www.github.com/cheminfo/nmr-processing/compare/v1.5.0...v1.5.1) (2021-07-16)
+
+
+### Bug Fixes
+
+* don't need openchemlib as dependency ([edecc62](https://www.github.com/cheminfo/nmr-processing/commit/edecc621b47b2c34982b807334429b4344d714b0))
+
 ## [1.5.0](https://www.github.com/cheminfo/nmr-processing/compare/v1.4.0...v1.5.0) (2021-07-15)
@@ -4,0 +11,0 @@

package.json

 {
   "name": "nmr-processing",
-  "version": "1.5.0",
+  "version": "1.5.1",
   "description": "",
@@ -5,0 +5,0 @@ "main": "lib/index.js",

src/prediction/utils/createInputJSON.js

@@ -5,7 +5,6 @@ import {
 } from 'openchemlib-utils';
-import OCL from 'openchemlib/minimal';
 
 export function createInputJSON(molecule, options) {
   const { levels } = options;
-
+  const OCL = molecule.getOCL();
   let diaIDs = getGroupedDiastereotopicAtomIDs(molecule);
@@ -12,0 +11,0 @@

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Improved metrics

Total package byte prevSize

338260

increased by0.05%

Worsened metrics

Lines of code

12610

decreased by-0.01%

No dependency changes