From 721803a92f9171d93b06ba8c243fee317f3b89e4 Mon Sep 17 00:00:00 2001 From: CoprDistGit Date: Mon, 29 May 2023 12:16:59 +0000 Subject: automatic import of python-pylj --- .gitignore | 1 + python-pylj.spec | 386 +++++++++++++++++++++++++++++++++++++++++++++++++++++++ sources | 1 + 3 files changed, 388 insertions(+) create mode 100644 python-pylj.spec create mode 100644 sources diff --git a/.gitignore b/.gitignore index e69de29..6c3a743 100644 --- a/.gitignore +++ b/.gitignore @@ -0,0 +1 @@ +/pylj-1.4.1.tar.gz diff --git a/python-pylj.spec b/python-pylj.spec new file mode 100644 index 0000000..b00ab9d --- /dev/null +++ b/python-pylj.spec @@ -0,0 +1,386 @@ +%global _empty_manifest_terminate_build 0 +Name: python-pylj +Version: 1.4.1 +Release: 1 +Summary: Simple teaching tool for classical MD simulation +License: MIT +URL: https://pypi.org/project/pylj/ +Source0: https://mirrors.nju.edu.cn/pypi/web/packages/4c/8f/c7ffefc271286685c04bb3faf8872f4636955c5de5bdcb66cb90bbe1a86f/pylj-1.4.1.tar.gz +BuildArch: noarch + +Requires: python3-jupyter +Requires: python3-numpy +Requires: python3-matplotlib +Requires: python3-cython +Requires: python3-numba + +%description + + +## Visit the [pylj](http://pythoninchemistry.org/pylj) webpage for more information about pylj. + +To build from source: + +```python + +pip install -r requirements.txt + +python setup.py build + +python setup.py install + +python setup.py test + +``` +Check out our publication in the [Journal of Open Source Education](http://jose.theoj.org/papers/58daa1a1a564dc8e0f99ffcdae20eb1d) to find out more about pylj. + +Be aware! pylj runs within a [Jupyter notebook](http://jupyter.org/), and therefore requires this to run. We advise installing [anaconda python](https://anaconda.org/) as this includes many required libraries as well as the Jupyter notebooks framework. + +If you need any help using pylj contact arm61 in the [pylj/HELP gitter chatroom](https://gitter.im/pylj/HELP). + +Check out some [examples](https://github.com/arm61/pylj/tree/master/examples) of how pylj can be used in undergraduate teaching exercises. + +## Badges + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + +
JOSE DOI + + status + +
Latest Release + + PyPi version + +
+ + DOI + +
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License + + License MIT + +
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+ + + + +%package -n python3-pylj +Summary: Simple teaching tool for classical MD simulation +Provides: python-pylj +BuildRequires: python3-devel +BuildRequires: python3-setuptools +BuildRequires: python3-pip +%description -n python3-pylj + + +## Visit the [pylj](http://pythoninchemistry.org/pylj) webpage for more information about pylj. + +To build from source: + +```python + +pip install -r requirements.txt + +python setup.py build + +python setup.py install + +python setup.py test + +``` +Check out our publication in the [Journal of Open Source Education](http://jose.theoj.org/papers/58daa1a1a564dc8e0f99ffcdae20eb1d) to find out more about pylj. + +Be aware! pylj runs within a [Jupyter notebook](http://jupyter.org/), and therefore requires this to run. We advise installing [anaconda python](https://anaconda.org/) as this includes many required libraries as well as the Jupyter notebooks framework. + +If you need any help using pylj contact arm61 in the [pylj/HELP gitter chatroom](https://gitter.im/pylj/HELP). + +Check out some [examples](https://github.com/arm61/pylj/tree/master/examples) of how pylj can be used in undergraduate teaching exercises. + +## Badges + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + +
JOSE DOI + + status + +
Latest Release + + PyPi version + +
+ + DOI + +
Documentation + + Documentation Status + +
License + + License MIT + +
Build Status + + Build Status + +
+ + Build Status + +
Coverage Status + + Coverage Status + +
Gitter + + Gitter chat + +
+ + + + +%package help +Summary: Development documents and examples for pylj +Provides: python3-pylj-doc +%description help + + +## Visit the [pylj](http://pythoninchemistry.org/pylj) webpage for more information about pylj. + +To build from source: + +```python + +pip install -r requirements.txt + +python setup.py build + +python setup.py install + +python setup.py test + +``` +Check out our publication in the [Journal of Open Source Education](http://jose.theoj.org/papers/58daa1a1a564dc8e0f99ffcdae20eb1d) to find out more about pylj. + +Be aware! pylj runs within a [Jupyter notebook](http://jupyter.org/), and therefore requires this to run. We advise installing [anaconda python](https://anaconda.org/) as this includes many required libraries as well as the Jupyter notebooks framework. + +If you need any help using pylj contact arm61 in the [pylj/HELP gitter chatroom](https://gitter.im/pylj/HELP). + +Check out some [examples](https://github.com/arm61/pylj/tree/master/examples) of how pylj can be used in undergraduate teaching exercises. + +## Badges + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + + +
JOSE DOI + + status + +
Latest Release + + PyPi version + +
+ + DOI + +
Documentation + + Documentation Status + +
License + + License MIT + +
Build Status + + Build Status + +
+ + Build Status + +
Coverage Status + + Coverage Status + +
Gitter + + Gitter chat + +
+ + + + +%prep +%autosetup -n pylj-1.4.1 + +%build +%py3_build + +%install +%py3_install +install -d -m755 %{buildroot}/%{_pkgdocdir} +if [ -d doc ]; then cp -arf doc %{buildroot}/%{_pkgdocdir}; fi +if [ -d docs ]; then cp -arf docs %{buildroot}/%{_pkgdocdir}; fi +if [ -d example ]; then cp -arf example %{buildroot}/%{_pkgdocdir}; fi +if [ -d examples ]; then cp -arf examples %{buildroot}/%{_pkgdocdir}; fi +pushd %{buildroot} +if [ -d usr/lib ]; then + find usr/lib -type f -printf "/%h/%f\n" >> filelist.lst +fi +if [ -d usr/lib64 ]; then + find usr/lib64 -type f -printf "/%h/%f\n" >> filelist.lst +fi +if [ -d usr/bin ]; then + find usr/bin -type f -printf "/%h/%f\n" >> filelist.lst +fi +if [ -d usr/sbin ]; then + find usr/sbin -type f -printf "/%h/%f\n" >> filelist.lst +fi +touch doclist.lst +if [ -d usr/share/man ]; then + find usr/share/man -type f -printf "/%h/%f.gz\n" >> doclist.lst +fi +popd +mv %{buildroot}/filelist.lst . +mv %{buildroot}/doclist.lst . + +%files -n python3-pylj -f filelist.lst +%dir %{python3_sitelib}/* + +%files help -f doclist.lst +%{_docdir}/* + +%changelog +* Mon May 29 2023 Python_Bot - 1.4.1-1 +- Package Spec generated diff --git a/sources b/sources new file mode 100644 index 0000000..c9e6b4c --- /dev/null +++ b/sources @@ -0,0 +1 @@ +b25075124a720a1c4eea6fea859c8979 pylj-1.4.1.tar.gz -- cgit v1.2.3