diff --git a/CHANGELOG.txt b/CHANGELOG.txt index 34d92fa480b0754be3153fa21a1c1403fec7e8e9..dc4b0a416dbd06bc58067bc353584b68b697204d 100644 --- a/CHANGELOG.txt +++ b/CHANGELOG.txt @@ -1,4 +1,4 @@ -Changes in Release 1.X.0 +Changes in Release 1.9.0 -------------------------------------------------------------------------------- * Improved compare-structures action (chain mapping handling and documentation). diff --git a/CMakeLists.txt b/CMakeLists.txt index 74a3348880146b72ffb3f3e045ef4502110eea98..065174c38250fcf10e35959228716be55a9a2f0b 100644 --- a/CMakeLists.txt +++ b/CMakeLists.txt @@ -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 8) +set (OST_VERSION_MINOR 9) 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} ${PROJECT_SOURCE_DIR}/cmake_support) diff --git a/singularity/README.rst b/singularity/README.rst index f90cf47553a96a3bf9eaab68970fcf91f2b109ff..7dbc72271e821a69dcafaa066a5e8940c4ae45b3 100644 --- a/singularity/README.rst +++ b/singularity/README.rst @@ -9,7 +9,7 @@ In order to build OST Singularity image: .. code-block:: bash cd <OST ROOT>/singularity - sudo singularity build ost.img Singularity.1.8.0 + sudo singularity build ost.img Singularity.1.9.0 .. note:: diff --git a/singularity/Singularity.1.8.0 b/singularity/Singularity.1.9.0 similarity index 99% rename from singularity/Singularity.1.8.0 rename to singularity/Singularity.1.9.0 index cf3e3813f5a36ceb0b17e46ffcdd6d1159d27c12..f4d5a7e339380e1a663c944670315642f2dcf876 100644 --- a/singularity/Singularity.1.8.0 +++ b/singularity/Singularity.1.9.0 @@ -17,7 +17,7 @@ export CPUS_FOR_MAKE=8 export PYTHONPATH="/usr/local/lib64/python2.7/site-packages:${PYTHONPATH}" # When changing OPENSTRUCTURE_VERSION make sure to change it also in the # environment section of singularity recipe (this file). -export OPENSTRUCTURE_VERSION="1.8.0" +export OPENSTRUCTURE_VERSION="1.9.0" export OPENSTRUCTURE_SHARE="/usr/local/share/ost" export MSMS_VERSION="2.6.1" export OPENMM_VERSION="7.1.1" @@ -223,7 +223,7 @@ cd /home # ENVIRONMENT ############################################################################## export OST_ROOT="/usr/local" -export OPENSTRUCTURE_VERSION="1.8.0" +export OPENSTRUCTURE_VERSION="1.9.0" 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}"