Reorganizes the project

README.rst

@@ -1,32 +1,31 @@
 =====================
-molden_modifier 0.1.0
+tidymol 0.1.0
 =====================
 
 Some tools to modify molden files.
 
 * Free software: MIT license
 
-Installation
+Development
 ============
 
 Use your package manager or use the following instructions to install it
 in a virtual environment::
 
     $ python3 -m venv .env
     $ source .env/bin/activate
-    $ pip install --upgrade pip
-    $ pip install --upgrade
+    $ pip install --upgrade pip setuptools wheel
     $ pip install -r devel-requirements.txt
-    $ python setup.py develop
+    $ pip install -e .
 
 Citation
 ========
 
 ::
 
-    @Misc{Loehel2020,
+    @Misc{Loehel2022,
       author = {Juergen Loehel and Alba Vargas-Caamal},
-      title  = {Molden-modifier 1.0},
-      year   = {2020},
-      url    = {https://github.com/jloehel/molden_modifier},
+      title  = {tidymol 1.0},
+      year   = {2022},
+      url    = {https://github.com/jloehel/tidymol},
     }

requirements.txt

@@ -1,5 +1,7 @@
 ply
 numpy
-docopt
+Cython
 molmod
 pandas
+loguru
+click

setup.py

@@ -38,17 +38,17 @@ def requires(filename):
 
 # ------------------------------------------------------
 setup(
-    name='molden_modifier',
+    name='tidymol',
     version='0.1.0',
     license='MIT',
-    description='Helps to modify molden files',
+    description='Little Chem Helper',
     long_description='%s\n%s' % (
         re.compile('^.. start-badges.*^.. end-badges', re.M | re.S).sub('', read('README.rst')),
         re.sub(':[a-z]+:`~?(.*?)`', r'``\1``', read('CHANGELOG.rst'))
     ),
     author='Jürgen Löhel',
     author_email='[email protected]',
-    url='https://bitbucket.com/jloehel/molden_modifier',
+    url='https://github.com/jloehel/tidymol',
     packages=find_packages('src'),
     package_dir={'': 'src'},
     py_modules=[splitext(basename(path))[0] for path in glob('src/*.py')],
@@ -85,7 +85,7 @@ def requires(filename):
 
     entry_points={
         'console_scripts': [
-            'molden_modifier = molden_modifier.cli:main',
+            'tidymol = tidymol.cli:main',
         ]
     },
 )