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authorYuri Victorovich <yuri@FreeBSD.org>2023-07-02 16:05:43 +0000
committerYuri Victorovich <yuri@FreeBSD.org>2023-07-02 16:39:50 +0000
commit7d7d9293d6ed86a1ca3d9e910f5ca19651f65439 (patch)
tree029acd67e2e3232847ab41e0fc9b7b6048bc5493
parentbb0fabfc7b47dafa38e4a7b4a9df74c380c401b3 (diff)
downloadports-7d7d9293d6ed86a1ca3d9e910f5ca19651f65439.tar.gz
ports-7d7d9293d6ed86a1ca3d9e910f5ca19651f65439.zip
science/py-pymatgen-analysis-alloys: New port: PyMatgen add-on library with classes useful for describing alloys
-rw-r--r--science/Makefile1
-rw-r--r--science/py-pymatgen-analysis-alloys/Makefile23
-rw-r--r--science/py-pymatgen-analysis-alloys/distinfo3
-rw-r--r--science/py-pymatgen-analysis-alloys/pkg-descr3
4 files changed, 30 insertions, 0 deletions
diff --git a/science/Makefile b/science/Makefile
index 71dfda4a6450..61b237d4bc7f 100644
--- a/science/Makefile
+++ b/science/Makefile
@@ -388,6 +388,7 @@
SUBDIR += py-pygmo2
SUBDIR += py-pyked
SUBDIR += py-pymatgen
+ SUBDIR += py-pymatgen-analysis-alloys
SUBDIR += py-pymbd
SUBDIR += py-pymol
SUBDIR += py-pyosf
diff --git a/science/py-pymatgen-analysis-alloys/Makefile b/science/py-pymatgen-analysis-alloys/Makefile
new file mode 100644
index 000000000000..e26a5f8c66aa
--- /dev/null
+++ b/science/py-pymatgen-analysis-alloys/Makefile
@@ -0,0 +1,23 @@
+PORTNAME= pymatgen-analysis-alloys
+DISTVERSION= 0.0.6
+CATEGORIES= science python
+MASTER_SITES= PYPI
+PKGNAMEPREFIX= ${PYTHON_PKGNAMEPREFIX}
+
+MAINTAINER= yuri@FreeBSD.org
+COMMENT= PyMatgen add-on library with classes useful for describing alloys
+WWW= https://github.com/materialsproject/pymatgen-analysis-alloys
+
+LICENSE= BSD3CLAUSE
+
+BUILD_DEPENDS= ${PYTHON_PKGNAMEPREFIX}setuptools>0:devel/py-setuptools@${PY_FLAVOR} \
+ ${PYTHON_PKGNAMEPREFIX}wheel>0:devel/py-wheel@${PY_FLAVOR}
+RUN_DEPENDS= ${PYTHON_PKGNAMEPREFIX}pymatgen>=2022.0.16:science/py-pymatgen@${PY_FLAVOR} \
+ ${PYTHON_PKGNAMEPREFIX}shapely>0:devel/py-shapely@${PY_FLAVOR}
+
+USES= python
+USE_PYTHON= pep517 autoplist
+
+NO_ARCH= yes
+
+.include <bsd.port.mk>
diff --git a/science/py-pymatgen-analysis-alloys/distinfo b/science/py-pymatgen-analysis-alloys/distinfo
new file mode 100644
index 000000000000..d36c270e2933
--- /dev/null
+++ b/science/py-pymatgen-analysis-alloys/distinfo
@@ -0,0 +1,3 @@
+TIMESTAMP = 1688313296
+SHA256 (pymatgen-analysis-alloys-0.0.6.tar.gz) = ff4975d874f07448cfe858acf5aa853a1cbfc25c9bb7ce5cf3b97463091cd58e
+SIZE (pymatgen-analysis-alloys-0.0.6.tar.gz) = 44750
diff --git a/science/py-pymatgen-analysis-alloys/pkg-descr b/science/py-pymatgen-analysis-alloys/pkg-descr
new file mode 100644
index 000000000000..377c01905bc2
--- /dev/null
+++ b/science/py-pymatgen-analysis-alloys/pkg-descr
@@ -0,0 +1,3 @@
+pymatgen-analysis-alloys is an add-on package for pymatgen intended to contain
+useful classes for describing alloy systems and analyzing data relevant to these
+systems. It currently contains the base classes and plotting functionality.