Implement thread-safe mathematical subroutines which deals with RGN. More...
Functions/Subroutines | |
subroutine | ggnml_thread_safe (gaus) |
Generate 3 gaussian random number. More... | |
subroutine | ggubs_thread_safe (unif) |
Generate an uniform distributed number between 0 and 1. More... | |
Implement thread-safe mathematical subroutines which deals with RGN.
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References: see also http://mcm.h-its.org/sda7/do:c/doc_sda7/references.html:
Brownian dynamics simulation of protein-protein diffusional encounter. (1998) Methods, 14, 329-341.
SDA 7: A modular and parallel implementation of the simulation of diffusional association software. Journal of computational chemistry 36.21 (2015): 1631-1645.
Authors: M.Martinez, N.J.Bruce, J.Romanowska, D.B.Kokh, P.Mereghetti, X. Yu, M. Ozboyaci, M. Reinhardt, P. Friedrich, R.R.Gabdoulline, S.Richter and R.C.Wade
see Random Number Generator section Theses subroutine call different generator depending if the compilation was done with OpenMP.
Allow the same function call, but a different implementation
subroutine ggnml_thread_safe | ( | real ( kind=8 ), dimension ( 3 ), intent(out) | gaus | ) |
Generate 3 gaussian random number.
Gaussian with mean 0 and variance 1 Safe function to call, in all cases
subroutine ggubs_thread_safe | ( | real ( kind=8 ), intent(out) | unif | ) |
Generate an uniform distributed number between 0 and 1.
Thread-safe function