diff --git a/doc/src/fix_restrain.txt b/doc/src/fix_restrain.txt index 1a7c7b6ba5df11d6c9331de0963e2bc562131e42..6d3e20bdea67b2d0c25bb4192e703f34498bf1d1 100644 --- a/doc/src/fix_restrain.txt +++ b/doc/src/fix_restrain.txt @@ -187,10 +187,16 @@ added forces to be included in the total potential energy of the system (the quantity being minimized), you MUST enable the "fix_modify"_fix_modify.html {energy} option for this fix. -This fix computes a global scalar, which can be accessed by various -"output commands"_Section_howto.html#howto_15. The scalar is the -potential energy for all the restraints as discussed above. The scalar -value calculated by this fix is "extensive". +This fix computes a global scalar and vector of length 3, which can be +accessed by various "output commands"_Section_howto.html#howto_15. The +scalar is the potential energy for all the restraints as discussed above. +The vector values are the following global quantities: + +1 = bond energy +2 = angle energy +3 = dihedral energy :ul + +The scalar and vector values calculated by this fix are "extensive". No parameter of this fix can be used with the {start/stop} keywords of the "run"_run.html command.