Skip to content

Commit

Permalink
Merge pull request #18 from isambard-uob/version-bump
Browse files Browse the repository at this point in the history
Bumps version number.
  • Loading branch information
ChrisWellsWood authored Mar 11, 2021
2 parents fa4deee + 5f717f0 commit febb9d4
Show file tree
Hide file tree
Showing 3 changed files with 45 additions and 38 deletions.
4 changes: 4 additions & 0 deletions README.md
Original file line number Diff line number Diff line change
Expand Up @@ -117,6 +117,10 @@ stuck.

# Release Notes

### v2.3.1

* Fixes a minor bug in the DSSP output parsing code

### v2.3.0

* **Introduces functionality to calculate the packing density (measured as the atomic contact number) of all non-hydrogen atoms in a Polymer / Assembly object.**
Expand Down
77 changes: 40 additions & 37 deletions setup.py
Original file line number Diff line number Diff line change
Expand Up @@ -7,43 +7,46 @@

def readme():
"""Loads the readme file for AMPAL."""
with open('README.md', 'r') as inf:
with open("README.md", "r") as inf:
return inf.read()


setup(name='ISAMBARD',
version='2.3.0',
description='A package for biomolecular analysis, modelling and design',
long_description=readme(),
long_description_content_type='text/markdown; charset=UTF-8; variant=GFM',
url='https://github.com/isambard-uob/isambard',
author='Woolfson Group, University of Bristol',
author_email='chris.wood@bristol.ac.uk',
classifiers=[
'Intended Audience :: Science/Research',
'License :: OSI Approved :: MIT License',
'Natural Language :: English',
'Topic :: Scientific/Engineering :: Bio-Informatics',
'Programming Language :: Python :: 3.5',
'Programming Language :: Python :: 3.6',
],
packages=find_packages('src'),
package_dir={'': 'src'},
include_package_data=True,
# This code automatically builds the Cython extensions.
ext_modules=cythonize(
[Extension(
"isambard.specifications.ta_polypeptide",
[("src/isambard/specifications/ta_polypeptide.pyx")]),
]
),
install_requires=[
'ampal',
'budeff',
'Cython',
'deap',
'matplotlib',
'numpy',
],
zip_safe=False,
)
setup(
name="ISAMBARD",
version="2.3.1",
description="A package for biomolecular analysis, modelling and design",
long_description=readme(),
long_description_content_type="text/markdown; charset=UTF-8; variant=GFM",
url="https://github.com/isambard-uob/isambard",
author="Woolfson Group, University of Bristol",
author_email="chris.wood@ed.ac.uk",
classifiers=[
"Intended Audience :: Science/Research",
"License :: OSI Approved :: MIT License",
"Natural Language :: English",
"Topic :: Scientific/Engineering :: Bio-Informatics",
"Programming Language :: Python :: 3.5",
"Programming Language :: Python :: 3.6",
],
packages=find_packages("src"),
package_dir={"": "src"},
include_package_data=True,
# This code automatically builds the Cython extensions.
ext_modules=cythonize(
[
Extension(
"isambard.specifications.ta_polypeptide",
[("src/isambard/specifications/ta_polypeptide.pyx")],
),
]
),
install_requires=[
"ampal",
"budeff",
"Cython",
"deap",
"matplotlib",
"numpy",
],
zip_safe=False,
)
2 changes: 1 addition & 1 deletion src/isambard/__init__.py
Original file line number Diff line number Diff line change
@@ -1,3 +1,3 @@
import ampal

__version__="2.3.0"
__version__ = "2.3.1"

0 comments on commit febb9d4

Please sign in to comment.