diff --git a/CHANGES/Unreleased.txt b/CHANGES/Unreleased.txt index f01347d22b3bc2b19d045d7849bb44a276487e0a..9a5acb419a64df4ed4b0d1fbc0d3488f9f2b186b 100644 --- a/CHANGES/Unreleased.txt +++ b/CHANGES/Unreleased.txt @@ -12,6 +12,7 @@ Changes from version 2.1 which are relevant for users: the switching function goes to zero. Users should always set this parameter when using a switching function in order to achieve optimal performance. - New actions + - \ref EXTENDED_LAGRANGIAN - \ref DFSCLUSTERING calculate the size of clusters - \ref DUMPMULTICOLVAR print out a multicolvar - \ref MFILTER_LESS filter multicolvar by the value of the colvar @@ -26,6 +27,7 @@ Changes from version 2.1 which are relevant for users: - Keywords for \ref GROUP (REMOVE, SORT, UNIQUE) - \ref DUMPATOMS now supports dumping xtc and trr files (requires xdrfile library). - \ref driver can now read xtc and trr files also with xdrfile library. + - Possibility to enable or disable \ref RESTART on a per action basis. - VMEAN and VSUM allow one to calculate the sum of a set of vectors calculated by VectorMultiColvar. Note these can also be used in tandem with \ref AROUND or \ref MFILTER_MORE to calculate the average vector within a particular part of the cell or the average vector amonst those that have a magnitude greater than some tolerance