diff --git a/CHANGELOG b/CHANGELOG index 61cdb5055..7773dc690 100644 --- a/CHANGELOG +++ b/CHANGELOG @@ -3,6 +3,17 @@ SIRE changelog devel branch: + [2020.1.0] July 2020 - Fixed bug in WaterView program to ensure that a + molecule is extracted from the returned list. Stable sorting + of dihedrals and other potential terms to allow reproducible + writing of input files for SOMD (@ptosco). Updated the + FreeEnergyAnalysis script to support different versions of the + pymbar API. Significant performance improvement to the GroTop + parser by looping over cut-groups during non-bonded matrix + evaluation. Updated Miniconda and conda dependencies to latest + cross-compatible versions. Fixed minor copiler and runtime + issues (@nigel-cresset). + [2019.3.0] November 2019 - Added functionality to restrict the search space when finding paths between atoms or searching for rings. Fixed performance issue in GroTop parser caused by an N^2 loop over diff --git a/corelib/CMakeLists.txt b/corelib/CMakeLists.txt index b4f9fe774..f83b2d9d1 100644 --- a/corelib/CMakeLists.txt +++ b/corelib/CMakeLists.txt @@ -6,8 +6,8 @@ # ################################ -set (S_VERSION_MAJOR "2019") -set (S_VERSION_MINOR "3") +set (S_VERSION_MAJOR "2020") +set (S_VERSION_MINOR "1") set (S_VERSION_PATCH "0") set (SIRE_VERSION "${S_VERSION_MAJOR}.${S_VERSION_MINOR}.${S_VERSION_PATCH}") diff --git a/wrapper/CMakeLists.txt b/wrapper/CMakeLists.txt index 4cd73d905..a7c1681ec 100644 --- a/wrapper/CMakeLists.txt +++ b/wrapper/CMakeLists.txt @@ -8,8 +8,8 @@ ################################ # project version -set (SIRE_VERSION_MAJOR "2019") -set (SIRE_VERSION_MINOR "3") +set (SIRE_VERSION_MAJOR "2020") +set (SIRE_VERSION_MINOR "1") set (SIRE_VERSION_PATCH "0") set (SIRE_VERSION "${SIRE_VERSION_MAJOR}.${SIRE_VERSION_MINOR}.${SIRE_VERSION_PATCH}")