| commit | 3c0347e0ec15071a658b227fa433fffce3b3e53d | |
| author | Teemu Murtola <teemu.murtola@cbr.su.se> | |
| Mon, 26 Oct 2009 17:26:43 +0000 (26 18:26 +0100) | ||
| committer | Teemu Murtola <teemu.murtola@cbr.su.se> | |
| Mon, 26 Oct 2009 17:26:43 +0000 (26 18:26 +0100) | ||
| tree | f59a48fc1d9cff92e71309381a514aeeffcc9f10 | treesnapshot (tar.gz zip) |
| parent | 05365cc3853aa87e08e9c061fa03de9c6561c5c0 | commitdiff |
Analysis lib. can now analyze just a topology.
The trajectory analysis library now handles the case when no trajectory
is given by preparing a frame from the coordinates in the topology and
calling the analysis callback once for this frame. The possibility to
analyze just the topology is useful at least for g_select for analyzing
static selections, and might be useful in other contexts.
The trajectory analysis library now handles the case when no trajectory
is given by preparing a frame from the coordinates in the topology and
calling the analysis callback once for this frame. The possibility to
analyze just the topology is useful at least for g_select for analyzing
static selections, and might be useful in other contexts.
| src/gmxlib/trajana/trajana.c | diffblobblamehistory |