rmsdRMSD_wrapper return issue

Open julenmendieta opened this issue 8 years ago • 1 comments

when "one" is set to True, "what" should be taken into account to return; score, rmsd, drmsd or eqv. Now it only returns drmsd

https://github.com/3DGenomes/TADbit/blob/a258dcf455e6674303d81359f2d684b846fdb67c/src/3d-lib/eqv_rms_drms_py.cpp#L108

Aug 11 '17 10:08 julenmendieta

should take into account this use of the one=True flag: https://github.com/3DGenomes/TADbit/blob/324bb0357d4071bef054dadefcd535216ba4ba02/_pytadbit/modelling/structuralmodels.py#L481 The documentation of the parameter one should also be changed... Right now it is not the RMSD returned, but the dRMSD (as @julenmendieta says)

Aug 11 '17 15:08 fransua