svn commit: r492529 - in head/science: . py-oddt
Yuri Victorovich
yuri at FreeBSD.org
Sat Feb 9 22:51:26 UTC 2019
Author: yuri
Date: Sat Feb 9 22:51:25 2019
New Revision: 492529
URL: https://svnweb.freebsd.org/changeset/ports/492529
Log:
New port: science/py-oddt: Open Drug Discovery Toolkit
Added:
head/science/py-oddt/
head/science/py-oddt/Makefile (contents, props changed)
head/science/py-oddt/distinfo (contents, props changed)
head/science/py-oddt/pkg-descr (contents, props changed)
Modified:
head/science/Makefile
Modified: head/science/Makefile
==============================================================================
--- head/science/Makefile Sat Feb 9 22:44:38 2019 (r492528)
+++ head/science/Makefile Sat Feb 9 22:51:25 2019 (r492529)
@@ -238,6 +238,7 @@
SUBDIR += py-molmod
SUBDIR += py-netCDF4
SUBDIR += py-obspy
+ SUBDIR += py-oddt
SUBDIR += py-openpiv
SUBDIR += py-paida
SUBDIR += py-paramz
Added: head/science/py-oddt/Makefile
==============================================================================
--- /dev/null 00:00:00 1970 (empty, because file is newly added)
+++ head/science/py-oddt/Makefile Sat Feb 9 22:51:25 2019 (r492529)
@@ -0,0 +1,28 @@
+# $FreeBSD$
+
+PORTNAME= oddt
+DISTVERSION= 0.6
+CATEGORIES= science python
+PKGNAMEPREFIX= ${PYTHON_PKGNAMEPREFIX}
+
+MAINTAINER= yuri at FreeBSD.org
+COMMENT= Open Drug Discovery Toolkit
+
+LICENSE= BSD3CLAUSE
+LICENSE_FILE= ${WRKSRC}/LICENSE
+
+BUILD_DEPENDS= ${PYNUMPY} \
+ ${PYTHON_PKGNAMEPREFIX}joblib>0:devel/py-joblib@${PY_FLAVOR} \
+ ${PYTHON_PKGNAMEPREFIX}pandas>0:math/py-pandas@${PY_FLAVOR} \
+ ${PYTHON_PKGNAMEPREFIX}scikit-learn>0:science/py-scikit-learn@${PY_FLAVOR} \
+ ${PYTHON_PKGNAMEPREFIX}scipy>=0.9.0:science/py-scipy@${PY_FLAVOR} \
+ ${PYTHON_PKGNAMEPREFIX}six>0:devel/py-six@${PY_FLAVOR}
+RUN_DEPENDS:= ${BUILD_DEPENDS}
+
+USES= python
+USE_GITHUB= yes
+USE_PYTHON= distutils concurrent autoplist
+
+NO_ARCH= yes
+
+.include <bsd.port.mk>
Added: head/science/py-oddt/distinfo
==============================================================================
--- /dev/null 00:00:00 1970 (empty, because file is newly added)
+++ head/science/py-oddt/distinfo Sat Feb 9 22:51:25 2019 (r492529)
@@ -0,0 +1,3 @@
+TIMESTAMP = 1549751740
+SHA256 (oddt-oddt-0.6_GH0.tar.gz) = 9fb2eb8e77ea4dbbe4e447ba0a11474696f9b68dc6a3bd0f83beda7d7e473e61
+SIZE (oddt-oddt-0.6_GH0.tar.gz) = 41762059
Added: head/science/py-oddt/pkg-descr
==============================================================================
--- /dev/null 00:00:00 1970 (empty, because file is newly added)
+++ head/science/py-oddt/pkg-descr Sat Feb 9 22:51:25 2019 (r492529)
@@ -0,0 +1,5 @@
+Open Drug Discovery Toolkit (ODDT) is modular and comprehensive toolkit for use
+in cheminformatics, molecular modeling etc. ODDT is written in Python, and make
+extensive use of numpy/scipy.
+
+WWW: https://github.com/oddt/oddt
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