From 5c64e2bc9d28240b5308882af2e6cf7505d444b6 Mon Sep 17 00:00:00 2001
From: Samo Penic <samo.penic@gmail.com>
Date: Tue, 07 Jun 2016 19:14:09 +0000
Subject: [PATCH] Fixed energy calculations

---
 src/tape |   16 +++++++++-------
 1 files changed, 9 insertions(+), 7 deletions(-)

diff --git a/src/tape b/src/tape
index 12f88cd..0784fac 100644
--- a/src/tape
+++ b/src/tape
@@ -12,7 +12,7 @@
 
 # Pressure calculations
 # (pswitch=1: calc. p*dV energy contribution)
-pswitch = 1
+pswitch = 0
 # pressure difference: p_inside - p_outside (in units kT/l_min^3):
 pressure=-10.0
 
@@ -21,7 +21,7 @@
 constvolprecision=1e-14
 
 #Constant area constraint (0 disable constant area, 2 enable constant area with epsarea)
-constareaswitch=2
+constareaswitch=0
 
 ####### Polymer (brush) definitions ###########
 # npoly is a number of polymers attached to npoly distinct vertices on vesicle
@@ -37,14 +37,14 @@
 # nfono is a number of monomers in each filament
 nfono=300
 # 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
 R_nucleus=0
-R_nucleusX=2.0
-R_nucleusY=6.0
-R_nucleusZ=2.0
+R_nucleusX=6.0
+R_nucleusY=12.0
+R_nucleusZ=6.0
 #######  Cell definitions ############
 nxmax=60
 nymax=60
@@ -54,7 +54,7 @@
 ####### Program Control ############
 #how many MC sweeps between subsequent records of states to disk
 #200000
-mcsweeps=20
+mcsweeps=200
 #how many initial mcsweeps*inititer MC sweeps before recording to disk?
 #2
 inititer=0
@@ -69,6 +69,8 @@
 
 #shut up if we are using cluster!!!
 quiet=false
+ 
+
 
 #what type of multiprocessing? (*none, smp, cluster, distributed, cuda, auto)
 #currently only none makes sense.

--
Gitblit v1.9.3