gmx::test::anonymous_namespace{updategroupscog.cpp} Namespace Reference

Variables
gmx::RVec	positions []
	Database of 51 water atom input positions (taken from spc216.gro) for use as test inputs. More...

Variable Documentation

gmx::RVec gmx::test::anonymous_namespace{updategroupscog.cpp}::positions[]

Initial value:

= { { .130, -.041, -.291 },  { .120, -.056, -.192 },  { .044, -.005, -.327 },
                          { -.854, -.406, .477 },  { -.900, -.334, .425 },  { -.858, -.386, .575 },
                          { .351, -.061, .853 },   { .401, -.147, .859 },   { .416, .016, .850 },
                          { -.067, -.796, .873 },  { -.129, -.811, .797 },  { -.119, -.785, .958 },
                          { -.635, -.312, -.356 }, { -.629, -.389, -.292 }, { -.687, -.338, -.436 },
                          { .321, -.919, .242 },   { .403, -.880, .200 },   { .294, -1.001, .193 },
                          { -.404, .735, .728 },   { -.409, .670, .803 },   { -.324, .794, .741 },
                          { .461, -.596, -.135 },  { .411, -.595, -.221 },  { .398, -.614, -.059 },
                          { -.751, -.086, .237 },  { -.811, -.148, .287 },  { -.720, -.130, .152 },
                          { .202, .285, -.364 },   { .122, .345, -.377 },   { .192, .236, -.278 },
                          { -.230, -.485, .081 },  { -.262, -.391, .071 },  { -.306, -.548, .069 },
                          { .464, -.119, .323 },   { .497, -.080, .409 },   { .540, -.126, .258 },
                          { -.462, .107, .426 },   { -.486, .070, .336 },   { -.363, .123, .430 },
                          { .249, -.077, -.621 },  { .306, -.142, -.571 },  { .233, -.110, -.714 },
                          { -.922, -.164, .904 },  { -.842, -.221, .925 },  { -.971, -.204, .827 },
                          { .382, .700, .480 },    { .427, .610, .477 },    { .288, .689, .513 },
                          { .781, .264, -.113 },   { .848, .203, -.070 },   { .708, .283, -.048 } }

Database of 51 water atom input positions (taken from spc216.gro) for use as test inputs.