From 1153c110781fc3add2c22ab2d996e05b0e0b10de Mon Sep 17 00:00:00 2001
From: Samo Penic <samo.penic@gmail.com>
Date: Sat, 08 Mar 2014 11:56:00 +0000
Subject: [PATCH] Merged branches polyel with constant volume

---
 src/tape |   20 +++++++++++++-------
 1 files changed, 13 insertions(+), 7 deletions(-)

diff --git a/src/tape b/src/tape
index f3c8bad..18eea15 100644
--- a/src/tape
+++ b/src/tape
@@ -1,16 +1,22 @@
 ####### Vesicle definitions ###########
 # nshell is a number of divisions of dipyramid
 nshell=17
-# dmax is the max. bond length 
+# dmax is the max. bond length (in units l_min)
 dmax=1.7
-# bending rigidity of the membrane 
-xk0=25.0
-# max step size 
+# bending rigidity of the membrane (in units kT)
+xk0=1.0
+# 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
 
 ####### Polymer definitions ###########
 # npoly is a number of polymers attached to npoly distinct vertices on vesicle
-npoly=2
+npoly=0
 # nmono is a number of monomers in each polymer
 nmono=10
 # Spring constant between monomers of the polymer
@@ -24,11 +30,11 @@
 
 ####### Program Control ############
 #how many MC sweeps between subsequent records of states to disk
-mcsweeps=5000
+mcsweeps=500
 #how many initial mcsweeps*inititer MC sweeps before recording to disk?
 inititer=1
 #how many records do you want on the disk iteration are there in a run?
-iterations=10000
+iterations=10
 
 
 #shut up if we are using cluster!!!

--
Gitblit v1.9.3