From 5c3143e7b7d0979d6eed07b6dfbe9f214159bdbb Mon Sep 17 00:00:00 2001
From: Samo Penic <samo.penic@gmail.com>
Date: Tue, 31 May 2016 19:42:00 +0000
Subject: [PATCH] Use nucleus displaced centre in vertex move

---
 src/initial_distribution.c |   28 ++++++++++++++++++++++------
 1 files changed, 22 insertions(+), 6 deletions(-)

diff --git a/src/initial_distribution.c b/src/initial_distribution.c
index 7d5647c..ae7de0b 100644
--- a/src/initial_distribution.c
+++ b/src/initial_distribution.c
@@ -1,3 +1,4 @@
+/* vim: set ts=4 sts=4 sw=4 noet : */
 #include<stdlib.h>
 #include<math.h>
 #include<stdio.h>
@@ -12,6 +13,7 @@
 #include "poly.h"
 #include "io.h"
 #include "sh.h"
+#include "shcomplex.h"
 
 ts_vesicle *initial_distribution_dipyramid(ts_uint nshell, ts_uint ncmax1, ts_uint ncmax2, ts_uint ncmax3, ts_double stepsize){
 	ts_fprintf(stdout,"Starting initial_distribution on vesicle with %u shells!...\n",nshell);
@@ -38,12 +40,21 @@
 
 ts_vesicle *create_vesicle_from_tape(ts_tape *tape){
 	ts_vesicle *vesicle;
-	ts_vertex *vtx;
 
 	vesicle=initial_distribution_dipyramid(tape->nshell,tape->ncxmax,tape->ncymax,tape->nczmax,tape->stepsize);
-	// Nucleus:
-	vesicle->R_nucleus=tape->R_nucleus*tape->R_nucleus;
+    	vesicle->tape=tape;
+	set_vesicle_values_from_tape(vesicle);
+	return vesicle;
+}
 
+ts_bool set_vesicle_values_from_tape(ts_vesicle *vesicle){
+	// Nucleus:
+	ts_vertex *vtx;
+	ts_tape *tape=vesicle->tape;
+	vesicle->R_nucleus=tape->R_nucleus*tape->R_nucleus;
+	vesicle->R_nucleusX=tape->R_nucleusX*tape->R_nucleusX;
+	vesicle->R_nucleusY=tape->R_nucleusY*tape->R_nucleusY;
+	vesicle->R_nucleusZ=tape->R_nucleusZ*tape->R_nucleusZ;
 	vesicle->clist->dmin_interspecies = tape->dmin_interspecies*tape->dmin_interspecies;
 
 	//Initialize grafted polymers (brush):
@@ -84,7 +95,7 @@
 	vesicle->dmax=tape->dmax*tape->dmax; /* dmax^2 in the vesicle dmax variable */
 	vesicle->bending_rigidity=tape->xk0;
 	vtx_set_global_values(vesicle); /* make xk0 default value for every vertex */ 
-	ts_fprintf(stdout, "Tape setting: xk0=%e\n",tape->xk0);
+//	ts_fprintf(stdout, "Tape setting: xk0=%e\n",tape->xk0);
 	vesicle->stepsize=tape->stepsize;
 	vesicle->clist->ncmax[0]=tape->ncxmax;
 	vesicle->clist->ncmax[1]=tape->ncymax;
@@ -93,8 +104,13 @@
 
 	vesicle->pressure= tape->pressure;
 	vesicle->pswitch=tape->pswitch;
-	vesicle->sphHarmonics=sph_init(vesicle->vlist,tape->shc);
-    return vesicle;
+    if(tape->shc>0){
+	    vesicle->sphHarmonics=complex_sph_init(vesicle->vlist,tape->shc);
+    }
+    else {
+        vesicle->sphHarmonics=NULL;
+    }
+    return TS_SUCCESS;
 
 }
 

--
Gitblit v1.9.3