From 8a66144c9118f8df80eba28c5b363fac574194da Mon Sep 17 00:00:00 2001
From: Samo Penic <samo.penic@gmail.com>
Date: Sat, 08 Mar 2014 18:25:18 +0000
Subject: [PATCH] Parsing command line arguments is still kind-of messy, but it workds for force-from-tape and reset-iteration-count
---
src/vertexmove.c | 12 ++++++++++--
1 files changed, 10 insertions(+), 2 deletions(-)
diff --git a/src/vertexmove.c b/src/vertexmove.c
index 86b8533..7f6391f 100644
--- a/src/vertexmove.c
+++ b/src/vertexmove.c
@@ -18,7 +18,7 @@
ts_double dist;
ts_bool retval;
ts_uint cellidx;
- ts_double delta_energy,oenergy;
+ ts_double delta_energy,oenergy,dvol=0.0;
ts_double costheta,sintheta,phi,r;
//This will hold all the information of vtx and its neighbours
ts_vertex backupvtx[20];
@@ -83,7 +83,9 @@
memcpy((void *)&backupvtx[i+1],(void *)vtx->neigh[i],sizeof(ts_vertex));
}
-
+ if(vesicle->pswitch == 1){
+ for(i=0;i<vtx->tristar_no;i++) dvol-=vtx->tristar[i]->volume;
+ };
delta_energy=0;
//update the normals of triangles that share bead i.
@@ -97,6 +99,12 @@
energy_vertex(vtx->neigh[i]);
delta_energy+=vtx->neigh[i]->xk*(vtx->neigh[i]->energy-oenergy);
}
+
+ if(vesicle->pswitch == 1){
+ for(i=0;i<vtx->tristar_no;i++) dvol+=vtx->tristar[i]->volume;
+ delta_energy-=vesicle->pressure*dvol;
+ };
+
/* No poly-bond energy for now!
if(vtx->grafted_poly!=NULL){
delta_energy+=
--
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