%global _empty_manifest_terminate_build 0
Name:		python-Soprano
Version:	0.8.13
Release:	1
Summary:	A Python library to crack crystals
License:	LGPL
URL:		https://ccp-nc.github.io/soprano/
Source0:	https://mirrors.nju.edu.cn/pypi/web/packages/3f/0a/34aecc18fc93f50a279c1200398e50bdb900969d4230b5ed6dfa25240115/Soprano-0.8.13.tar.gz
BuildArch:	noarch

Requires:	python3-numpy
Requires:	python3-scipy
Requires:	python3-ase

%description

Soprano is a Python library developed and maintained by the CCP for NMR
Crystallography as a tool to help scientists working with crystallography and
simulations to generate, manipulate, run calculations on and analyse large
data sets of crystal structures, with a particular attention to the output of
ab-initio random structure searching,
or AIRSS. (https://www.mtg.msm.cam.ac.uk/Codes/AIRSS)

It provides a number of functionalities to help automate many common tasks
in computational crystallography.



%package -n python3-Soprano
Summary:	A Python library to crack crystals
Provides:	python-Soprano
BuildRequires:	python3-devel
BuildRequires:	python3-setuptools
BuildRequires:	python3-pip
%description -n python3-Soprano

Soprano is a Python library developed and maintained by the CCP for NMR
Crystallography as a tool to help scientists working with crystallography and
simulations to generate, manipulate, run calculations on and analyse large
data sets of crystal structures, with a particular attention to the output of
ab-initio random structure searching,
or AIRSS. (https://www.mtg.msm.cam.ac.uk/Codes/AIRSS)

It provides a number of functionalities to help automate many common tasks
in computational crystallography.



%package help
Summary:	Development documents and examples for Soprano
Provides:	python3-Soprano-doc
%description help

Soprano is a Python library developed and maintained by the CCP for NMR
Crystallography as a tool to help scientists working with crystallography and
simulations to generate, manipulate, run calculations on and analyse large
data sets of crystal structures, with a particular attention to the output of
ab-initio random structure searching,
or AIRSS. (https://www.mtg.msm.cam.ac.uk/Codes/AIRSS)

It provides a number of functionalities to help automate many common tasks
in computational crystallography.



%prep
%autosetup -n Soprano-0.8.13

%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-Soprano -f filelist.lst
%dir %{python3_sitelib}/*

%files help -f doclist.lst
%{_docdir}/*

%changelog
* Tue May 30 2023 Python_Bot <Python_Bot@openeuler.org> - 0.8.13-1
- Package Spec generated