Publish

- [email protected] - [email protected] - [email protected] - [email protected] - [email protected] - [email protected] - [email protected] - [email protected] - [email protected] - [email protected] - [email protected] - [email protected] - [email protected] - [email protected] - [email protected] - [email protected] - [email protected] - [email protected] - [email protected] - [email protected]
cheminfo · Dec 18, 2024 · 4348a70 · 4348a70
1 parent a81e0f5
commit 4348a70
Show file tree

Hide file tree

Showing 40 changed files with 252 additions and 89 deletions.
diff --git a/packages/emdb/CHANGELOG.md b/packages/emdb/CHANGELOG.md
@@ -3,6 +3,14 @@
 All notable changes to this project will be documented in this file.
 See [Conventional Commits](https://conventionalcommits.org) for commit guidelines.
 
+## [3.3.17](https://github.com/cheminfo/mass-tools/compare/[email protected]@3.3.17) (2024-12-18)
+
+**Note:** Version bump only for package emdb
+
+
+
+
+
 ## [3.3.16](https://github.com/cheminfo/mass-tools/compare/[email protected]@3.3.16) (2024-12-17)
 
 **Note:** Version bump only for package emdb

diff --git a/packages/emdb/package.json b/packages/emdb/package.json
@@ -1,6 +1,6 @@
 {
   "name": "emdb",
-  "version": "3.3.16",
+  "version": "3.3.17",
   "description": "Database manager for exact mass query",
   "main": "lib/src/index.js",
   "module": "src/index.js",
@@ -22,22 +22,22 @@
   "dependencies": {
     "chemical-elements": "^2.2.0",
     "chemical-groups": "^2.2.2",
-    "isotopic-distribution": "^3.4.7",
+    "isotopic-distribution": "^3.4.8",
     "jszip": "^3.10.1",
-    "mass-fragmentation": "^1.11.3",
-    "mf-finder": "^3.4.10",
-    "mf-from-google-sheet": "^3.1.10",
-    "mf-generator": "^3.3.10",
-    "mf-matcher": "^3.2.10",
-    "mf-parser": "^3.2.8",
-    "mf-utilities": "^3.3.3",
+    "mass-fragmentation": "^1.11.4",
+    "mf-finder": "^3.4.11",
+    "mf-from-google-sheet": "^3.1.11",
+    "mf-generator": "^3.3.11",
+    "mf-matcher": "^3.2.11",
+    "mf-parser": "^3.3.0",
+    "mf-utilities": "^3.3.4",
     "ml-regression-theil-sen": "^3.0.0",
     "ml-spectra-processing": "^14.7.0",
-    "ms-spectrum": "^3.7.5",
-    "nucleotide": "^3.2.3",
+    "ms-spectrum": "^3.7.6",
+    "nucleotide": "^3.2.4",
     "openchemlib-utils": "^6.4.1",
     "peaks-similarity": "^3.1.1",
-    "peptide": "^2.3.3"
+    "peptide": "^2.3.4"
   },
   "devDependencies": {
     "jest-matcher-deep-close-to": "^3.0.2",

diff --git a/packages/isotopic-distribution/CHANGELOG.md b/packages/isotopic-distribution/CHANGELOG.md
@@ -3,6 +3,14 @@
 All notable changes to this project will be documented in this file.
 See [Conventional Commits](https://conventionalcommits.org) for commit guidelines.
 
+## [3.4.8](https://github.com/cheminfo/mass-tools/compare/[email protected]@3.4.8) (2024-12-18)
+
+**Note:** Version bump only for package isotopic-distribution
+
+
+
+
+
 ## [3.4.7](https://github.com/cheminfo/mass-tools/compare/[email protected]@3.4.7) (2024-12-17)
 
 **Note:** Version bump only for package isotopic-distribution

diff --git a/packages/isotopic-distribution/package.json b/packages/isotopic-distribution/package.json
@@ -1,6 +1,6 @@
 {
   "name": "isotopic-distribution",
-  "version": "3.4.7",
+  "version": "3.4.8",
   "description": "Calculate the isotopic distribution of a molecular formula",
   "main": "lib/src/index.js",
   "module": "src/index.js",
@@ -21,8 +21,8 @@
   "homepage": "https://github.com/cheminfo/mass-tools/tree/main/packages/isotopic-distribution#readme",
   "dependencies": {
     "chemical-elements": "^2.2.0",
-    "mf-parser": "^3.2.8",
-    "mf-utilities": "^3.3.3",
+    "mf-parser": "^3.3.0",
+    "mf-utilities": "^3.3.4",
     "ml-spectra-processing": "^14.9.0",
     "spectrum-generator": "^8.0.12"
   },

diff --git a/packages/mass-fragmentation/CHANGELOG.md b/packages/mass-fragmentation/CHANGELOG.md
@@ -3,6 +3,14 @@
 All notable changes to this project will be documented in this file.
 See [Conventional Commits](https://conventionalcommits.org) for commit guidelines.
 
+## [1.11.4](https://github.com/cheminfo/mass-tools/compare/[email protected]@1.11.4) (2024-12-18)
+
+**Note:** Version bump only for package mass-fragmentation
+
+
+
+
+
 ## [1.11.3](https://github.com/cheminfo/mass-tools/compare/[email protected]@1.11.3) (2024-12-17)
 
 **Note:** Version bump only for package mass-fragmentation

diff --git a/packages/mass-fragmentation/package.json b/packages/mass-fragmentation/package.json
@@ -1,6 +1,6 @@
 {
   "name": "mass-fragmentation",
-  "version": "1.11.3",
+  "version": "1.11.4",
   "description": "Code to fragment molecules",
   "main": "lib/src/index.js",
   "module": "src/index.js",
@@ -20,7 +20,7 @@
   },
   "homepage": "https://github.com/cheminfo/mass-tools/tree/main/packages/mass-fragmentation#readme",
   "dependencies": {
-    "mf-parser": "^3.2.8",
+    "mf-parser": "^3.3.0",
     "openchemlib-utils": "^6.4.1",
     "react-tree-svg": "^1.4.0"
   },

diff --git a/packages/mass-tools/CHANGELOG.md b/packages/mass-tools/CHANGELOG.md
@@ -3,6 +3,14 @@
 All notable changes to this project will be documented in this file.
 See [Conventional Commits](https://conventionalcommits.org) for commit guidelines.
 
+## [2.2.15](https://github.com/cheminfo/mass-tools/compare/[email protected]@2.2.15) (2024-12-18)
+
+**Note:** Version bump only for package mass-tools
+
+
+
+
+
 ## [2.2.14](https://github.com/cheminfo/mass-tools/compare/[email protected]@2.2.14) (2024-12-17)
 
 **Note:** Version bump only for package mass-tools

diff --git a/packages/mass-tools/package.json b/packages/mass-tools/package.json
@@ -1,6 +1,6 @@
 {
   "name": "mass-tools",
-  "version": "2.2.14",
+  "version": "2.2.15",
   "main": "lib/src/index.js",
   "description": "Many tools allowing to analyze mass spectra",
   "module": "src/index.js",
@@ -22,21 +22,21 @@
     "atom-sorter": "^2.2.0",
     "chemical-elements": "^2.2.0",
     "chemical-groups": "^2.2.2",
-    "emdb": "^3.3.16",
-    "isotopic-distribution": "^3.4.7",
-    "mass-fragmentation": "^1.11.3",
-    "mf-from-atomic-ratio": "^1.2.10",
-    "mf-from-ea": "^2.1.10",
-    "mf-generator": "^3.3.10",
-    "mf-parser": "^3.2.8",
-    "mf-utilities": "^3.3.3",
-    "mfs-deconvolution": "^2.4.16",
-    "ms-report": "^3.2.11",
-    "ms-spectrum": "^3.7.5",
-    "nucleotide": "^3.2.3",
-    "octochemdb": "^2.10.7",
+    "emdb": "^3.3.17",
+    "isotopic-distribution": "^3.4.8",
+    "mass-fragmentation": "^1.11.4",
+    "mf-from-atomic-ratio": "^1.2.11",
+    "mf-from-ea": "^2.1.11",
+    "mf-generator": "^3.3.11",
+    "mf-parser": "^3.3.0",
+    "mf-utilities": "^3.3.4",
+    "mfs-deconvolution": "^2.4.17",
+    "ms-report": "^3.2.12",
+    "ms-spectrum": "^3.7.6",
+    "nucleotide": "^3.2.4",
+    "octochemdb": "^2.10.8",
     "peaks-similarity": "^3.1.1",
-    "peptide": "^2.3.3",
+    "peptide": "^2.3.4",
     "sum-object-keys": "^1.0.2"
   }
 }
diff --git a/packages/mf-finder/CHANGELOG.md b/packages/mf-finder/CHANGELOG.md
@@ -3,6 +3,14 @@
 All notable changes to this project will be documented in this file.
 See [Conventional Commits](https://conventionalcommits.org) for commit guidelines.
 
+## [3.4.11](https://github.com/cheminfo/mass-tools/compare/[email protected]@3.4.11) (2024-12-18)
+
+**Note:** Version bump only for package mf-finder
+
+
+
+
+
 ## [3.4.10](https://github.com/cheminfo/mass-tools/compare/[email protected]@3.4.10) (2024-12-17)
 
 **Note:** Version bump only for package mf-finder

diff --git a/packages/mf-finder/package.json b/packages/mf-finder/package.json
@@ -1,6 +1,6 @@
 {
   "name": "mf-finder",
-  "version": "3.4.10",
+  "version": "3.4.11",
   "description": "Find a molecular formula from a monoisotopic mass",
   "main": "lib/src/index.js",
   "module": "src/index.js",
@@ -22,8 +22,8 @@
   "dependencies": {
     "atom-sorter": "^2.2.0",
     "chemical-elements": "^2.2.0",
-    "mf-matcher": "^3.2.10",
-    "mf-parser": "^3.2.8",
-    "mf-utilities": "^3.3.3"
+    "mf-matcher": "^3.2.11",
+    "mf-parser": "^3.3.0",
+    "mf-utilities": "^3.3.4"
   }
 }
diff --git a/packages/mf-from-atomic-ratio/CHANGELOG.md b/packages/mf-from-atomic-ratio/CHANGELOG.md
@@ -3,6 +3,14 @@
 All notable changes to this project will be documented in this file.
 See [Conventional Commits](https://conventionalcommits.org) for commit guidelines.
 
+## [1.2.11](https://github.com/cheminfo/mass-tools/compare/[email protected]@1.2.11) (2024-12-18)
+
+**Note:** Version bump only for package mf-from-atomic-ratio
+
+
+
+
+
 ## [1.2.10](https://github.com/cheminfo/mass-tools/compare/[email protected]@1.2.10) (2024-12-17)
 
 **Note:** Version bump only for package mf-from-atomic-ratio

diff --git a/packages/mf-from-atomic-ratio/package.json b/packages/mf-from-atomic-ratio/package.json
@@ -1,6 +1,6 @@
 {
   "name": "mf-from-atomic-ratio",
-  "version": "1.2.10",
+  "version": "1.2.11",
   "description": "Find a molecular formula from atomic ratio",
   "main": "lib/src/index.js",
   "module": "src/index.js",
@@ -20,8 +20,8 @@
   },
   "homepage": "https://github.com/cheminfo/mass-tools/tree/main/packages/mf-from-atomic-ratio#readme",
   "dependencies": {
-    "mf-generator": "^3.3.10",
-    "mf-parser": "^3.2.8"
+    "mf-generator": "^3.3.11",
+    "mf-parser": "^3.3.0"
   },
   "devDependencies": {
     "jest-matcher-deep-close-to": "^3.0.2"

diff --git a/packages/mf-from-ea/CHANGELOG.md b/packages/mf-from-ea/CHANGELOG.md
@@ -3,6 +3,14 @@
 All notable changes to this project will be documented in this file.
 See [Conventional Commits](https://conventionalcommits.org) for commit guidelines.
 
+## [2.1.11](https://github.com/cheminfo/mass-tools/compare/[email protected]@2.1.11) (2024-12-18)
+
+**Note:** Version bump only for package mf-from-ea
+
+
+
+
+
 ## [2.1.10](https://github.com/cheminfo/mass-tools/compare/[email protected]@2.1.10) (2024-12-17)
 
 **Note:** Version bump only for package mf-from-ea

diff --git a/packages/mf-from-ea/package.json b/packages/mf-from-ea/package.json
@@ -1,6 +1,6 @@
 {
   "name": "mf-from-ea",
-  "version": "2.1.10",
+  "version": "2.1.11",
   "description": "Find a molecular formula from elemental analysis results",
   "main": "lib/src/index.js",
   "module": "src/index.js",
@@ -22,8 +22,8 @@
   "dependencies": {
     "atom-sorter": "^2.2.0",
     "chemical-elements": "^2.2.0",
-    "mf-parser": "^3.2.8",
-    "mf-utilities": "^3.3.3"
+    "mf-parser": "^3.3.0",
+    "mf-utilities": "^3.3.4"
   },
   "devDependencies": {
     "jest-matcher-deep-close-to": "^3.0.2"

diff --git a/packages/mf-from-google-sheet/CHANGELOG.md b/packages/mf-from-google-sheet/CHANGELOG.md
@@ -3,6 +3,14 @@
 All notable changes to this project will be documented in this file.
 See [Conventional Commits](https://conventionalcommits.org) for commit guidelines.
 
+## [3.1.11](https://github.com/cheminfo/mass-tools/compare/[email protected]@3.1.11) (2024-12-18)
+
+**Note:** Version bump only for package mf-from-google-sheet
+
+
+
+
+
 ## [3.1.10](https://github.com/cheminfo/mass-tools/compare/[email protected]@3.1.10) (2024-12-17)
 
 **Note:** Version bump only for package mf-from-google-sheet

diff --git a/packages/mf-from-google-sheet/package.json b/packages/mf-from-google-sheet/package.json
@@ -1,6 +1,6 @@
 {
   "name": "mf-from-google-sheet",
-  "version": "3.1.10",
+  "version": "3.1.11",
   "description": "Retrieve and format molecular formula from google sheet",
   "main": "lib/src/index.js",
   "module": "src/index.js",
@@ -20,9 +20,9 @@
   },
   "homepage": "https://github.com/cheminfo/mass-tools/tree/main/packages/mf-from-google-sheet#readme",
   "dependencies": {
-    "mf-generator": "^3.3.10",
-    "mf-parser": "^3.2.8",
-    "mf-utilities": "^3.3.3",
+    "mf-generator": "^3.3.11",
+    "mf-parser": "^3.3.0",
+    "mf-utilities": "^3.3.4",
     "papaparse": "^5.4.1"
   }
 }
diff --git a/packages/mf-generator/CHANGELOG.md b/packages/mf-generator/CHANGELOG.md
@@ -3,6 +3,14 @@
 All notable changes to this project will be documented in this file.
 See [Conventional Commits](https://conventionalcommits.org) for commit guidelines.
 
+## [3.3.11](https://github.com/cheminfo/mass-tools/compare/[email protected]@3.3.11) (2024-12-18)
+
+**Note:** Version bump only for package mf-generator
+
+
+
+
+
 ## [3.3.10](https://github.com/cheminfo/mass-tools/compare/[email protected]@3.3.10) (2024-12-17)
 
 **Note:** Version bump only for package mf-generator

diff --git a/packages/mf-generator/package.json b/packages/mf-generator/package.json
@@ -1,6 +1,6 @@
 {
   "name": "mf-generator",
-  "version": "3.3.10",
+  "version": "3.3.11",
   "description": "Generate molecular formula based on a range and filters",
   "main": "lib/src/index.js",
   "module": "src/index.js",
@@ -21,10 +21,10 @@
   "homepage": "https://github.com/cheminfo/mass-tools/tree/main/packages/mf-generator#readme",
   "dependencies": {
     "chemical-elements": "^2.2.0",
-    "mf-finder": "^3.4.10",
-    "mf-matcher": "^3.2.10",
-    "mf-parser": "^3.2.8",
-    "mf-utilities": "^3.3.3",
+    "mf-finder": "^3.4.11",
+    "mf-matcher": "^3.2.11",
+    "mf-parser": "^3.3.0",
+    "mf-utilities": "^3.3.4",
     "sum-object-keys": "^1.0.2"
   },
   "devDependencies": {

diff --git a/packages/mf-global/CHANGELOG.md b/packages/mf-global/CHANGELOG.md
@@ -3,6 +3,14 @@
 All notable changes to this project will be documented in this file.
 See [Conventional Commits](https://conventionalcommits.org) for commit guidelines.
 
+## [3.1.17](https://github.com/cheminfo/mass-tools/compare/[email protected]@3.1.17) (2024-12-18)
+
+**Note:** Version bump only for package mf-global
+
+
+
+
+
 ## [3.1.16](https://github.com/cheminfo/mass-tools/compare/[email protected]@3.1.16) (2024-12-17)
 
 **Note:** Version bump only for package mf-global