From 2ae815f58a40d4b86f5183d7e2ec406d5e0f5d65 Mon Sep 17 00:00:00 2001 From: Samo Penic <samo.penic@gmail.com> Date: Wed, 09 May 2018 14:47:15 +0000 Subject: [PATCH] Prepared for stretching --- src/tape | 27 ++++++++++++++++++++++----- 1 files changed, 22 insertions(+), 5 deletions(-) diff --git a/src/tape b/src/tape index 69fd056..70f526a 100644 --- a/src/tape +++ b/src/tape @@ -23,11 +23,16 @@ #Constant area constraint (0 disable constant area, 2 enable constant area with epsarea) constareaswitch=0 + +#Stretching +stretchswitch=1 +xkA0=10.0 + ####### Polymer (brush) definitions ########### # npoly is a number of polymers attached to npoly distinct vertices on vesicle -npoly=800 +npoly=0 # nmono is a number of monomers in each polymer -nmono=6 +nmono=10 # Spring constant between monomers of the polymer k_spring=800 #set to 1 if half of the polymeres are inside the vesicle @@ -39,7 +44,7 @@ # nfono is a number of monomers in each filament nfono=3 # Persistence lenght of the filaments (in units l_min) -xi=0 +xi=100 ####### Nucleus (inside the vesicle) ########### # Radius of an impenetrable hard sphere inside the vesicle @@ -56,10 +61,10 @@ ####### Program Control ############ #how many MC sweeps between subsequent records of states to disk #200000 -mcsweeps=200 +mcsweeps=2000 #how many initial mcsweeps*inititer MC sweeps before recording to disk? #2 -inititer=10 +inititer=1 #how many records do you want on the disk iteration are there in a run? #10000 iterations=100 @@ -71,6 +76,8 @@ #shut up if we are using cluster!!! quiet=false + + #what type of multiprocessing? (*none, smp, cluster, distributed, cuda, auto) #currently only none makes sense. @@ -82,3 +89,13 @@ #max number of processes in distributed (voluntary) environment distributed_processes=50 #cuda options??? + + +#number of vertices with spontaneous curvature (integer) +number_of_vertices_with_c0=100 +#c0/2 is spontaneous curvature. c0 is used as (c1+c1-c0)^2 in energy term (float) +c0=0.5 +#energy of attraction of vertices with spontaneous curvature (float, positive value for attraction) +w=10.0 +#direct force on vesicles with spontaneous curvature (float) +F=2.0 -- Gitblit v1.9.3