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schwede
openstructure
Commits
99855c18
Commit
99855c18
authored
5 years ago
by
Gerardo Tauriello
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Update version to 1.11.0
parent
383e8aea
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4 changed files
CHANGELOG.txt
+1
-1
1 addition, 1 deletion
CHANGELOG.txt
CMakeLists.txt
+1
-1
1 addition, 1 deletion
CMakeLists.txt
docker/Dockerfile
+1
-1
1 addition, 1 deletion
docker/Dockerfile
singularity/Singularity
+2
-2
2 additions, 2 deletions
singularity/Singularity
with
5 additions
and
5 deletions
CHANGELOG.txt
+
1
−
1
View file @
99855c18
Changes in Release 1.
X
.0
Changes in Release 1.
11
.0
--------------------------------------------------------------------------------
* This is expected to be the last release supporting Python 2.
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CMakeLists.txt
+
1
−
1
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99855c18
...
...
@@ -6,7 +6,7 @@ cmake_minimum_required(VERSION 2.6.4 FATAL_ERROR)
project
(
OpenStructure CXX C
)
set
(
CMAKE_EXPORT_COMPILE_COMMANDS 1
)
set
(
OST_VERSION_MAJOR 1
)
set
(
OST_VERSION_MINOR 1
0
)
set
(
OST_VERSION_MINOR 1
1
)
set
(
OST_VERSION_PATCH 0
)
set
(
OST_VERSION_STRING
${
OST_VERSION_MAJOR
}
.
${
OST_VERSION_MINOR
}
.
${
OST_VERSION_PATCH
}
)
set
(
CMAKE_MODULE_PATH
${
CMAKE_MODULE_PATH
}
${
PROJECT_SOURCE_DIR
}
/cmake_support
)
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docker/Dockerfile
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−
1
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99855c18
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@@ -3,7 +3,7 @@ FROM ubuntu:18.04
# ARGUMENTS
###########
ARG
OPENSTRUCTURE_VERSION="1.1
0
.0"
ARG
OPENSTRUCTURE_VERSION="1.1
1
.0"
ARG
SRC_FOLDER="/usr/local/src"
ARG
CPUS_FOR_MAKE=8
ARG
PYTHONPATH="/usr/local/lib64/python2.7/site-packages:${PYTHONPATH}"
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singularity/Singularity
+
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−
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99855c18
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@@ -17,7 +17,7 @@ export CPUS_FOR_MAKE=8
export PYTHONPATH="/usr/local/lib64/python2.7/site-packages:${PYTHONPATH}"
# When changing OPENSTRUCTURE_VERSION make sure to change it also in the
# environment section of singularity recipe (this file).
export OPENSTRUCTURE_VERSION="1.1
0
.0"
export OPENSTRUCTURE_VERSION="1.1
1
.0"
export OPENSTRUCTURE_SHARE="/usr/local/share/ost"
export MSMS_VERSION="2.6.1"
export OPENMM_VERSION="7.1.1"
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...
@@ -214,7 +214,7 @@ cd /home
# ENVIRONMENT
##############################################################################
export OST_ROOT="/usr/local"
export OPENSTRUCTURE_VERSION="1.1
0
.0"
export OPENSTRUCTURE_VERSION="1.1
1
.0"
export OPENMM_LIB_PATH=/usr/local/openmm/lib/
export PYTHONPATH="/usr/local/lib64/python2.7/site-packages:${PYTHONPATH}"
export LD_LIBRARY_PATH="$LD_LIBRARY_PATH:/usr/local/lib64:${OPENMM_LIB_PATH}"
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