SDA (SDA flex)  7.2
Simulation of Diffusional Association
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tools Directory Reference
Directory dependency graph for tools:

Directories

 DT-Grid
 
 ECM
 

Files

 analyze_subroutines.f90
 
 calc_solvaccess.f90
 
 cluster_sdamm.f90
 
 contacts_sdamm.f90
 
 convert_grid.f90
 
 convert_traj_sdamm.f90
 Tool to convert SDA 7 many molecules trajectory to old SDAMM fort.55 format.
 
 dcc.f90
 
 diffusion_calc.f90
 
 energy_analyze.f90
 
 gen_init_box.f90
 
 genbox_subroutines.f90
 
 get_clusters_per_frame.f90
 
 make_edhdlj_grid.f90
 
 mod_histogram.f90
 
 mod_pdb_type.f90
 
 mod_sda_input_tools.f90
 
 nos2rates.f90
 
 rdf.f90
 Compute the radial distribution function.
 
 read_record.f90
 
 rot_diffusion.f90
 
 surf_trans_diffusion.f90
 
 trajectory2dcd.f90
 
 trans_diffusion.f90
 Compute the autocorrelation function and translational diffusion coefficients.
 
 utils_diffusion.f90
 
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