Author: tlinnet Date: Sun Mar 16 20:13:27 2014 New Revision: 22483 URL: http://svn.gna.org/viewcvs/relax?rev=22483&view=rev Log: Added print-out of Omega, the average resonance offset, in calc_rotating_frame_params(). Regarding sr #3124, (https://gna.org/support/index.php?3124) - Grace graphs production for R1rho analysis with R2_eff as function of Omega_eff. Modified: trunk/specific_analyses/relax_disp/disp_data.py Modified: trunk/specific_analyses/relax_disp/disp_data.py URL: http://svn.gna.org/viewcvs/relax/trunk/specific_analyses/relax_disp/disp_data.py?rev=22483&r1=22482&r2=22483&view=diff ============================================================================== --- trunk/specific_analyses/relax_disp/disp_data.py (original) +++ trunk/specific_analyses/relax_disp/disp_data.py Sun Mar 16 20:13:27 2014 @@ -208,7 +208,7 @@ # Loop over the index of spins, then exp_type, frq, offset if verbosity: print("Printing the following") - print("exp_type spin_id frq offset{ppm} offsets[ei][si][mi][oi]{rad/s} ei mi oi si di cur_spin.chemical_shift{ppm} chemical_shifts[ei][si][mi]{rad/s} spin_lock_nu1{Hz} tilt_angles[ei][si][mi][oi]{rad}") + print("exp_type spin_id frq offset{ppm} offsets[ei][si][mi][oi]{rad/s} ei mi oi si di cur_spin.chemical_shift{ppm} chemical_shifts[ei][si][mi]{rad/s} spin_lock_nu1{Hz} tilt_angles[ei][si][mi][oi]{rad} av_res_offset[ei][si][mi][oi]{rad/s}") si = 0 theta_spin_dic = dict() @@ -221,7 +221,7 @@ spin_lock_fields = spin_lock_nu1[ei][mi][oi] for di in range(len(spin_lock_fields)): if verbosity: - print("%-8s %-10s %11.1f %8.4f %12.5f %i %i %i %i %i %7.3f %12.5f %12.5f %12.5f"%(exp_type, spin_id, frq, offset, offsets[ei][si][mi][oi], ei, mi, oi, si, di, spin.chemical_shift, chemical_shifts[ei][si][mi], spin_lock_fields[di], tilt_angles[ei][si][mi][oi][di])) + print("%-8s %-10s %11.1f %8.4f %12.5f %i %i %i %i %i %7.3f %12.5f %12.5f %12.5f %12.5f"%(exp_type, spin_id, frq, offset, offsets[ei][si][mi][oi], ei, mi, oi, si, di, spin.chemical_shift, chemical_shifts[ei][si][mi], spin_lock_fields[di], tilt_angles[ei][si][mi][oi][di], Delta_omega[ei][si][mi][oi][di])) dic_key = return_param_key_from_data(exp_type=exp_type, frq=frq, offset=offset, point=spin_lock_fields[di]) dic_key_list.append(dic_key) theta_spin_dic["%s"%(dic_key)] = tilt_angles[ei][si][mi][oi][di]