From 37d14a0a50ed40f536cc3821b3584552e1b75c5c Mon Sep 17 00:00:00 2001 From: Samo Penic <samo@CAE-linux.(none)> Date: Mon, 07 Apr 2014 19:55:16 +0000 Subject: [PATCH] added statistics output to the outer loop --- src/tape | 28 +++++++++++++++++----------- 1 files changed, 17 insertions(+), 11 deletions(-) diff --git a/src/tape b/src/tape index 38871bd..dbaabdb 100644 --- a/src/tape +++ b/src/tape @@ -3,6 +3,8 @@ 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=10.0 # max step size (in units l_min) @@ -10,9 +12,9 @@ # Pressure calculations # (pswitch=1: calc. p*dV energy contribution) -pswitch = 0 +pswitch = 1 # pressure difference: p_inside - p_outside (in units kT/l_min^3): -pressure=0.0 +pressure=-1.0 ####### Polymer (brush) definitions ########### # npoly is a number of polymers attached to npoly distinct vertices on vesicle @@ -23,12 +25,16 @@ k_spring=800 ####### Filament (inside the vesicle) definitions ########### -# npoly is a number of polymers attached to npoly distinct vertices on vesicle -nfil=0 -# nmono is a number of monomers in each filament -nfono=10 -# Spring constant between monomers of the filament -k_sfring=800 +# 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 @@ -38,11 +44,11 @@ ####### 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=1000 +iterations=20 #shut up if we are using cluster!!! -- Gitblit v1.9.3