From 51f7fd23ba4e56dc198273eb795c8d1730cf4dbe Mon Sep 17 00:00:00 2001 From: Samo Penic <samo.penic@gmail.com> Date: Mon, 19 Apr 2021 13:54:45 +0000 Subject: [PATCH] Work in progress --- src/tape | 35 ++++++++++++++++++++++++----------- 1 files changed, 24 insertions(+), 11 deletions(-) diff --git a/src/tape b/src/tape index bad3739..41bd4da 100644 --- a/src/tape +++ b/src/tape @@ -14,7 +14,7 @@ # (pswitch=1: calc. p*dV energy contribution) pswitch = 0 # pressure difference: p_inside - p_outside (in units kT/l_min^3): -pressure=10.0 +pressure=10000.0 #Constant volume constraint (0 disable constant volume, 1 enable wiht additional vertex move, 2 enable with epsvol) constvolswitch=0 @@ -23,15 +23,20 @@ #Constant area constraint (0 disable constant area, 2 enable constant area with epsarea) constareaswitch=0 + +#Stretching +stretchswitch=0 +xkA0=1.0 + ####### 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=20 # Spring constant between monomers of the polymer k_spring=800 #set to 1 if half of the polymeres are inside the vesicle -internal_poly=1 +internal_poly=0 ####### Filament (inside the vesicle) definitions ########### # nfil is a number of filaments inside the vesicle @@ -48,18 +53,18 @@ R_nucleusY=0 R_nucleusZ=0 ####### Cell definitions ############ -nxmax=60 -nymax=60 -nzmax=60 +nxmax=100 +nymax=100 +nzmax=100 ####### Program Control ############ #how many MC sweeps between subsequent records of states to disk #200000 -mcsweeps=2000 +mcsweeps=200 #how many initial mcsweeps*inititer MC sweeps before recording to disk? #2 -inititer=10 +inititer=0 #how many records do you want on the disk iteration are there in a run? #10000 iterations=100 @@ -86,12 +91,20 @@ #cuda options??? -#NirGov branch only! #number of vertices with spontaneous curvature (integer) number_of_vertices_with_c0=100 -#spontaneous curvature (float) +#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 + + + +#plane confinement +plane_confinement_switch=0 +#final plane distance (float in lmin) +plane_d=10 +#plane to vesicle repulsion force while closing +plane_F=10 -- Gitblit v1.9.3