Merge branch 'master' of https://github.com/Sulstice/global-chem

.github/workflows/pre-commit.yml

@@ -0,0 +1,16 @@
+name: pre-commit
+
+on:
+  pull_request:
+  push:
+    branches: [main]
+
+jobs:
+  pre-commit:
+    runs-on: ubuntu-latest
+    steps:
+    - uses: actions/checkout@v2
+    - uses: actions/setup-python@v2
+    - uses: pre-commit/action@v2.0.3
+      with:
+        extra_args: flake8 --all-files

README.md

@@ -1,5 +1,5 @@
-Global-Chem: A Chemical Graph Network Toolkit of common small molecules and their IUPAC/SMILES/SMARTS to support diverse chemical communities
-=============================================================================================================================================
+Global-Chem: A Chemical Knowledge Graph Toolkit of common small molecules and their IUPAC/SMILES/SMARTS to support diverse chemical communities
+===============================================================================================================================================
 
 Global Chem is an open-source graph database and api for common and rare chemical lists using IUPAC as input and SMILES/SMARTS as output. As 
 mostly needed by myself as I search through chemical infinity.
@@ -17,10 +17,10 @@ Overview
 
 | Usage     | Build  | Release | SMILES Validation | Licensing | Stats |  
 | --------- | ------ | ------- | ----------------- | --------- | ----- |
-| [![Documentation](https://img.shields.io/badge/GitBook-Docu-lightblue)](https://sulstice.gitbook.io/globalchem-your-chemical-graph-network/) | [![Test System](https://github.com/Sulstice/global-chem/actions/workflows/continous_integration.yml/badge.svg)](https://github.com/Sulstice/global-chem/actions/workflows/continous_integration.yml) | [![PyPI version](https://badge.fury.io/py/global-chem.svg)](https://badge.fury.io/py/global-chem) | [![saythanks](https://img.shields.io/badge/RDKit-100%25-fg49b4.svg)]() | [![License: MPL 2.0](https://img.shields.io/badge/License-MPL%202.0-brightgreen.svg)](https://opensource.org/licenses/MPL-2.0) | [![Downloads](https://pepy.tech/badge/global-chem)](https://pepy.tech/project/global-chem) | 
-| [![Website shields.io](https://img.shields.io/website-up-down-green-red/http/shields.io.svg)](http://www.chemicalgraphtheory.com) | [![Coverage Status](https://coveralls.io/repos/github/Sulstice/global-chem/badge.svg?branch=master)](https://coveralls.io/github/Sulstice/global-chem?branch=master) | [![DOI](https://zenodo.org/badge/259046250.svg)](https://zenodo.org/badge/latestdoi/259046250) | [![saythanks](https://img.shields.io/badge/PartialSMILES-85.7%25-fg49b4.svg)]() | [![FOSSA Status](https://app.fossa.com/api/projects/git%2Bgithub.com%2FSulstice%2Fglobal-chem.svg?type=shield)](https://app.fossa.com/projects/git%2Bgithub.com%2FSulstice%2Fglobal-chem?ref=badge_shield) | ![Repo Size](https://img.shields.io/github/repo-size/Sulstice/global-chem) |
-| [![Open In Colab](https://colab.research.google.com/assets/colab-badge.svg)](https://colab.research.google.com/drive/1gGx4mOmkXP8voGelHwCt8Eq4Xq8Lj5_k?usp=sharing) | [![PEP8](https://img.shields.io/badge/code%20style-pep8-orange.svg)](https://www.python.org/dev/peps/pep-0008/) | [![Maturity badge - level 2](https://img.shields.io/badge/Maturity-Level%202%20--%20First%20Release-yellowgreen.svg)](https://github.com/tophat/getting-started/blob/master/scorecard.md) | [![saythanks](https://img.shields.io/badge/PySMILES-99.8%25-fg49b4.svg)]()  |
-| ![Python](https://img.shields.io/badge/python-3.6-blue.svg) | | | [![saythanks](https://img.shields.io/badge/MolVS-98.5%25-lm89b5.svg)]() | |
+| [![Documentation](https://img.shields.io/badge/GitBook-Docu-lightblue)](https://sulstice.gitbook.io/globalchem-your-chemical-graph-network/) | [![Test System](https://github.com/Sulstice/global-chem/actions/workflows/continous_integration.yml/badge.svg)](https://github.com/Sulstice/global-chem/actions/workflows/continous_integration.yml) | [![PyPI version](https://badge.fury.io/py/global-chem.svg)](https://badge.fury.io/py/global-chem) | [![saythanks](https://img.shields.io/badge/RDKit-100%25-fg49b4.svg)](https://www.rdkit.org/) | [![License: MPL 2.0](https://img.shields.io/badge/License-MPL%202.0-brightgreen.svg)](https://opensource.org/licenses/MPL-2.0) | [![Downloads](https://pepy.tech/badge/global-chem)](https://pepy.tech/project/global-chem) | 
+| [![Website shields.io](https://img.shields.io/website-up-down-green-red/http/shields.io.svg)](http://www.chemicalgraphtheory.com) | [![Coverage Status](https://coveralls.io/repos/github/Sulstice/global-chem/badge.svg?branch=master)](https://coveralls.io/github/Sulstice/global-chem?branch=master) | [![DOI](https://zenodo.org/badge/259046250.svg)](https://zenodo.org/badge/latestdoi/259046250) | [![saythanks](https://img.shields.io/badge/PartialSMILES-85.7%25-fg49b4.svg)](https://github.com/baoilleach/partialsmiles) | [![FOSSA Status](https://app.fossa.com/api/projects/git%2Bgithub.com%2FSulstice%2Fglobal-chem.svg?type=shield)](https://app.fossa.com/projects/git%2Bgithub.com%2FSulstice%2Fglobal-chem?ref=badge_shield) | ![Repo Size](https://img.shields.io/github/repo-size/Sulstice/global-chem) |
+| [![Open In Colab](https://colab.research.google.com/assets/colab-badge.svg)](https://colab.research.google.com/drive/1gGx4mOmkXP8voGelHwCt8Eq4Xq8Lj5_k?usp=sharing) | [![PEP8](https://img.shields.io/badge/code%20style-pep8-orange.svg)](https://www.python.org/dev/peps/pep-0008/) | [![Maturity badge - level 2](https://img.shields.io/badge/Maturity-Level%202%20--%20First%20Release-yellowgreen.svg)](https://github.com/tophat/getting-started/blob/master/scorecard.md) | [![saythanks](https://img.shields.io/badge/PySMILES-99.8%25-fg49b4.svg)](https://github.com/pckroon/pysmiles)  |
+| ![Python](https://img.shields.io/badge/python-3.6-blue.svg) | | | [![saythanks](https://img.shields.io/badge/MolVS-98.5%25-lm89b5.svg)](https://github.com/mcs07/MolVS) | |
 
 
 Installation 

global_chem/setup.py

@@ -30,7 +30,7 @@
 # ----
 setup(
     name="global_chem",
-    version="1.5.5",
+    version="1.5.6",
     packages=find_packages(),
     license='MPL 2.0',
     author="Suliman Sharif",