Author: bugman Date: Wed Nov 14 11:54:44 2012 New Revision: 17966 URL: http://svn.gna.org/viewcvs/relax?rev=17966&view=rev Log: Reverted r17957 and r17958 as these are no longer compatible with the previous reversion. The command used was: svn merge -r17958:r17956 . Modified: branches/frame_order_testing/maths_fns/frame_order/matrix_ops.py branches/frame_order_testing/maths_fns/frame_order/pseudo_ellipse.py Modified: branches/frame_order_testing/maths_fns/frame_order/matrix_ops.py URL: http://svn.gna.org/viewcvs/relax/branches/frame_order_testing/maths_fns/frame_order/matrix_ops.py?rev=17966&r1=17965&r2=17966&view=diff ============================================================================== --- branches/frame_order_testing/maths_fns/frame_order/matrix_ops.py (original) +++ branches/frame_order_testing/maths_fns/frame_order/matrix_ops.py Wed Nov 14 11:54:44 2012 @@ -153,9 +153,15 @@ return pcs -def pcs_pivot_motion_full_qrint(full_in_ref_frame=None, r_pivot_atom=None, r_pivot_atom_rev=None, r_ln_pivot=None, A=None, R_eigen=None, RT_eigen=None, Ri_prime=None, pcs_theta=None, pcs_theta_err=None, missing_pcs=None, error_flag=False): +def pcs_pivot_motion_full_qrint(theta_i=None, phi_i=None, sigma_i=None, full_in_ref_frame=None, r_pivot_atom=None, r_pivot_atom_rev=None, r_ln_pivot=None, A=None, R_eigen=None, RT_eigen=None, Ri_prime=None, pcs_theta=None, pcs_theta_err=None, missing_pcs=None, error_flag=False): """Calculate the PCS value after a pivoted motion for the isotropic cone model. + @keyword theta_i: The half cone opening angle (polar angle). + @type theta_i: float + @keyword phi_i: The cone azimuthal angle. + @type phi_i: float + @keyword sigma_i: The torsion angle for state i. + @type sigma_i: float @keyword full_in_ref_frame: An array of flags specifying if the tensor in the reference frame is the full or reduced tensor. @type full_in_ref_frame: numpy rank-1 array @keyword r_pivot_atom: The pivot point to atom vector. Modified: branches/frame_order_testing/maths_fns/frame_order/pseudo_ellipse.py URL: http://svn.gna.org/viewcvs/relax/branches/frame_order_testing/maths_fns/frame_order/pseudo_ellipse.py?rev=17966&r1=17965&r2=17966&view=diff ============================================================================== --- branches/frame_order_testing/maths_fns/frame_order/pseudo_ellipse.py (original) +++ branches/frame_order_testing/maths_fns/frame_order/pseudo_ellipse.py Wed Nov 14 11:54:44 2012 @@ -808,7 +808,7 @@ continue # Calculate the PCSs for this state. - pcs_pivot_motion_full_qrint(full_in_ref_frame=self.full_in_ref_frame, r_pivot_atom=self.r_pivot_atom, r_pivot_atom_rev=self.r_pivot_atom_rev, r_ln_pivot=self.r_ln_pivot, A=self.A, R_eigen=self.R_eigen, RT_eigen=self.RT_eigen, Ri_prime=self.Ri_prime[i], pcs_theta=self.pcs_theta, pcs_theta_err=self.pcs_theta_err, missing_pcs=self.missing_pcs) + pcs_pivot_motion_full_qrint(theta_i=theta, phi_i=phi, sigma_i=sigma, full_in_ref_frame=self.full_in_ref_frame, r_pivot_atom=self.r_pivot_atom, r_pivot_atom_rev=self.r_pivot_atom_rev, r_ln_pivot=self.r_ln_pivot, A=self.A, R_eigen=self.R_eigen, RT_eigen=self.RT_eigen, Ri_prime=self.Ri_prime[i], pcs_theta=self.pcs_theta, pcs_theta_err=self.pcs_theta_err, missing_pcs=self.missing_pcs) # Increment the number of points. num += 1