diff --git a/CHANGELOG.txt b/CHANGELOG.txt index 756433b61f7255ab276d3789f2085a8eaef12f0d..7fa72744ab8b0779c24e9f1a12418f72c903e4c8 100644 --- a/CHANGELOG.txt +++ b/CHANGELOG.txt @@ -1,4 +1,4 @@ -Changes in Release 2.x +Changes in Release 2.7.0 -------------------------------------------------------------------------------- * mmCIF writing support. @@ -21,7 +21,6 @@ Changes in Release 2.6.1 * Bugfix in DockQ computation when using ost.mol.scoring - Changes in Release 2.6.0 -------------------------------------------------------------------------------- diff --git a/CMakeLists.txt b/CMakeLists.txt index 7a659871bf319f7f99ed8ddcbce1d581f191bb9f..9fd6b1c0339e3108d6a60d346ec4b6b82bcdb2ff 100644 --- a/CMakeLists.txt +++ b/CMakeLists.txt @@ -14,8 +14,8 @@ cmake_policy(SET CMP0060 NEW) project(OpenStructure CXX C) set (CMAKE_EXPORT_COMPILE_COMMANDS 1) set (OST_VERSION_MAJOR 2) -set (OST_VERSION_MINOR 6) -set (OST_VERSION_PATCH 1) +set (OST_VERSION_MINOR 7) +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) include(OST) diff --git a/docker/Dockerfile b/docker/Dockerfile index 4f7de8f9a7e3f0deb4d9b49d5c4e417b4c289049..075735de67f94fa7207ed4ff6bfd69377bdaa500 100644 --- a/docker/Dockerfile +++ b/docker/Dockerfile @@ -2,7 +2,7 @@ FROM ubuntu:22.04 # ARGUMENTS ########### -ARG OPENSTRUCTURE_VERSION="2.6.1" +ARG OPENSTRUCTURE_VERSION="2.7.0" ARG SRC_FOLDER="/usr/local/src" ARG CPUS_FOR_MAKE=2 ARG OPENMM_VERSION="7.7.0" diff --git a/singularity/Singularity b/singularity/Singularity index bc04d900abcd31a9e93314ea46f93d34eace5d4a..57dee2eb53faad64c77557d7ddc53e03bb3c90ba 100644 --- a/singularity/Singularity +++ b/singularity/Singularity @@ -1,5 +1,5 @@ BootStrap: docker -From: registry.scicore.unibas.ch/schwede/openstructure:2.6.1-jammy +From: registry.scicore.unibas.ch/schwede/openstructure:2.7.0-jammy %post ############################################################################## # POST