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pipeline:meridien:sp_higher_ord_abber [2021/03/16 10:52]
aali
pipeline:meridien:sp_higher_ord_abber [2021/03/16 10:58]
aali
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 === Main Parameters === === Main Parameters ===
  
-  ; post_refine_folder : The user has to be provide the location of the post refiner directory so that the script can automatically detect all the required information for the polishing. (default required string) +  ; post_refine_folder : Post Refine Folder: Input folder is the directory where the results of the post refiner are present and python routine automatically locates all the required files used for ctf refinement. (default required string) 
-  ; motioncorr_starfile The metadata star file which is being generated by MotionCorr. (default required string) +  ; output_folder Output folder : Output folder is the directory where all the results of the ctf refinement are saved. (default required string) 
-  ; output_directory Toplevel directory where outputs will be written. (default required string+  ; %%--%%estimate_magnification Estimate (anisotropic) magnification  : Estimate magnification of dataset . (default False
-  ; %%--%%training_params In case if the user wants to do the training part of the polishing then this is NoneOtherwise provide the optimize_params.txt file. (default none+  ; %%--%%estimate_beamtilt Estimate beamtilt : Estimate beamtilt from the dataset. (default False)  
-  ; %%--%%min_no_particles Number of particles to inlcude for training. (default 5000)+  ; %%--%%estimate_trefoil : Also estimate trefoil : estimate 3-fold astigmatism per optics group .(default False)  
 +  ; %%--%%estimate_order_aberation : Estimate the 4th order aberrations  :  Estimate the 4th order aberation .(default False)  
 +  ; %%--%%perform_CTF_params_fit : Perform CTF parameter fitting : Perform CTF parameter fitting(default False) 
 +  ; %%--%%fit_defocus_micrograph : Fit defocus based on micrographs : Fit defocus based on micrographs. (default False)  
 +  ; %%--%%fit_defocus_particle Fit defocus based on particles : Fit defocus based on particles. (default False)  
 +  ; %%--%%fit_astigmatism_micrograph :  Fit astigmatism based on micrographs : Fit astigmatism based on micrographs .(default False)  
 +  ; %%--%%fit_astigmatism_particle : Fit astigmatism based on particles : Fit astigmatism based on particles. (default False)  
 +  ; %%--%%fit_bfactor_micrograph : Fit bfactor based on micrographs : Fit bfactor based on micrographs. (default False) 
 +  ; %%--%%fit_bfactor_particle : Fit bfactor based on particles : Fit bfactor based on particles. (default False) 
 +  ; %%--%%fit_phase_shift_micrograph : Fit phase shift estimation for micrographs : Fit phase shift estimation for micrographs .(default False)  
 +  ; %%--%%fit_phase_shift_particle : Fit phase shift estimation for particles : Fit phase shift estimation for particles. (default False)  
 +  ; %%--%%min_res_fit : minimum resolution value for fitting (A) : minimum resolution value for fitting (default 30.0)
   ; %%--%%submission_template :  Submission template for MPI command. In case of running this tool on a cluster, always a submission template. The number of MPI processors and threads in the submission template should be the same as the one specified below in the MPI procs and threads value.(default none)   ; %%--%%submission_template :  Submission template for MPI command. In case of running this tool on a cluster, always a submission template. The number of MPI processors and threads in the submission template should be the same as the one specified below in the MPI procs and threads value.(default none)
   ; %%--%%submission_command : Submission commmand for cluster (default sbatch)   ; %%--%%submission_command : Submission commmand for cluster (default sbatch)
   ; %%--%%relion_mpirun_executable :  Since there can be more than one mpirun environment installed on a workstation or on a cluster. It can be sometimes necessary to provide the relion specific mpirun executable. Just type which mpirun -a in a terminal and choose the one which relion requires. (default mpirun)   ; %%--%%relion_mpirun_executable :  Since there can be more than one mpirun environment installed on a workstation or on a cluster. It can be sometimes necessary to provide the relion specific mpirun executable. Just type which mpirun -a in a terminal and choose the one which relion requires. (default mpirun)
-  ; %%--%%relion_polishing_executable : Similar to the issue of relion mpirun executable, it can be sometime necessary to provide the specific relion polishing executable also. Just type which relion_motion_refine_mpi and copy the path here. (default relion_motion_refine_mpi)+  ; %%--%%relion_ctfrefine_executable : Similar to the issue of relion mpirun executable, it can be sometime necessary to provide the specific relion polishing executable also. Just type which relion_ctf_refine_mpi and copy the path here. (default relion_ctf_refine_mpi)
   ; %%--%%mpi_procs :  The number of MPI processors used for Relion multiprocessing. For training part only one MPI processors is used. In case when running the program on cluster, the MPI processors value should be same as used in the submission template.(default 1)   ; %%--%%mpi_procs :  The number of MPI processors used for Relion multiprocessing. For training part only one MPI processors is used. In case when running the program on cluster, the MPI processors value should be same as used in the submission template.(default 1)
   ; %%--%%no_of_threads :  The number of threads use during the polishing. In case when running the program on cluster, the thread value should be same as used in the submission template.(default 1)   ; %%--%%no_of_threads :  The number of threads use during the polishing. In case when running the program on cluster, the thread value should be same as used in the submission template.(default 1)
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 === Advanced Parameters === === Advanced Parameters ===
  
-  ; %%--%%first_frame : The 1st frame number from where it should start. (default 1) 
-  ; %%--%%last_frame : The last frame number where it should end. (default -1) 
-  ; %%--%%bfac_minfreq :  The minimum frequency range which is normally the maximum inner shell to include in enhancement. (default 20) 
-  ; %%--%%bfac_maxfreq :  The minimum frequency range which is normally the maximum outer shell to include in enhancement. (default -1) 
   ; %%--%%mrc_reloc_folder : In case if the mrcs images were moved from original location where they were generated to a new location. Then the user has to provide a path directory link to the new location . (default none)   ; %%--%%mrc_reloc_folder : In case if the mrcs images were moved from original location where they were generated to a new location. Then the user has to provide a path directory link to the new location . (default none)
  
 ===== Output ===== ===== Output =====
-  ; shiny.star : Output star file for polishing particles. +  ; particles_ctf_refine.star : Output star file for polishing particles. 
-  ; bdb:polished_stack : : Polished particles stack.+  ; bdb:ctfrefine_stack : : Ctf refined particles stack. (still in test phase)
   ; BDB2STAR : Using sphire2relion tool , the bdb stack is converted to star file so that it can be used in relion. The star file is saved in BDB2STAR folder.   ; BDB2STAR : Using sphire2relion tool , the bdb stack is converted to star file so that it can be used in relion. The star file is saved in BDB2STAR folder.
-  ; PostProcess : Since the input to the tool is Post refiner directory, the tool can automatically create the necessary file in PostProcess folder which is necessary to provide for polishing.+  ; PostProcess : Since the input to the tool is Post refiner directory, the tool can automatically create the necessary file in PostProcess folder which is necessary to provide for ctf refinement.
  
 =====   ===== =====   =====
pipeline/meridien/sp_higher_ord_abber.txt · Last modified: 2021/03/22 16:49 by aali