From dc77e8ef10378188ee0a9657cedd1b7991a0a29f Mon Sep 17 00:00:00 2001 From: Samo Penic <samo@CAE-linux.(none)> Date: Wed, 09 Apr 2014 21:27:38 +0000 Subject: [PATCH] Added spherical harmonics as-is into rbc --- src/tape | 35 ++++++++++++++++++++++++++--------- 1 files changed, 26 insertions(+), 9 deletions(-) diff --git a/src/tape b/src/tape index b3aa6d4..833acaa 100644 --- a/src/tape +++ b/src/tape @@ -3,24 +3,38 @@ nshell=17 # dmax is the max. bond length (in units l_min) dmax=1.7 +# dmin_interspecies in the min. dist. between different vertex species (in units l_min) +dmin_interspecies=1.2 # bending rigidity of the membrane (in units kT) -xk0=25.0 +xk0=10.0 # max step size (in units l_min) stepsize=0.15 # Pressure calculations # (pswitch=1: calc. p*dV energy contribution) -pswitch = 0 -# pressure difference: p_inside - p_outside (in units l_min^3/kT): -pressure=0.0 +pswitch = 1 +# pressure difference: p_inside - p_outside (in units kT/l_min^3): +pressure=-1.0 -####### Polymer definitions ########### +####### Polymer (brush) definitions ########### # npoly is a number of polymers attached to npoly distinct vertices on vesicle -npoly=1 +npoly=0 # nmono is a number of monomers in each polymer nmono=10 # Spring constant between monomers of the polymer k_spring=800 + +####### Filament (inside the vesicle) definitions ########### +# nfil is a number of filaments inside the vesicle +nfil=2 +# nfono is a number of monomers in each filament +nfono=300 +# Persistence lenght of the filaments (in units l_min) +xi=5000 + +####### Nucleus (inside the vesicle) ########### +# Radius of an impenetrable hard sphere inside the vesicle +R_nucleus=5 ####### Cell definitions ############ nxmax=60 @@ -30,13 +44,16 @@ ####### Program Control ############ #how many MC sweeps between subsequent records of states to disk -mcsweeps=5000 +mcsweeps=10 #how many initial mcsweeps*inititer MC sweeps before recording to disk? -inititer=1 +inititer=0 #how many records do you want on the disk iteration are there in a run? -iterations=10 +iterations=2000 +###### Spherical harmonics ########### +spherical_harmonics_coefficients=21 + #shut up if we are using cluster!!! quiet=false -- Gitblit v1.9.3