From 7d62fc765adc11bbcb7db0716ac5dc19145dca80 Mon Sep 17 00:00:00 2001
From: Samo Penic <samo.penic@gmail.com>
Date: Sun, 15 Jun 2014 10:58:40 +0000
Subject: [PATCH] To be sure a fix in comparing the floating point numbers
---
src/initial_distribution.c | 15 ++++++++++++---
1 files changed, 12 insertions(+), 3 deletions(-)
diff --git a/src/initial_distribution.c b/src/initial_distribution.c
index a93e2ee..35d533d 100644
--- a/src/initial_distribution.c
+++ b/src/initial_distribution.c
@@ -11,6 +11,8 @@
#include "energy.h"
#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);
@@ -40,8 +42,11 @@
ts_vertex *vtx;
vesicle=initial_distribution_dipyramid(tape->nshell,tape->ncxmax,tape->ncymax,tape->nczmax,tape->stepsize);
+ vesicle->tape=tape;
// Nucleus:
- vesicle->R_nucleus=tape->R_nucleus;
+ vesicle->R_nucleus=tape->R_nucleus*tape->R_nucleus;
+
+ vesicle->clist->dmin_interspecies = tape->dmin_interspecies*tape->dmin_interspecies;
//Initialize grafted polymers (brush):
vesicle->poly_list=init_poly_list(tape->npoly,tape->nmono, vesicle->vlist, vesicle);
@@ -79,7 +84,6 @@
vesicle->nshell=tape->nshell;
vesicle->dmax=tape->dmax*tape->dmax; /* dmax^2 in the vesicle dmax variable */
- vesicle->clist->dmin_interspecies = tape->dmin_interspecies*tape->dmin_interspecies;
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);
@@ -91,7 +95,12 @@
vesicle->pressure= tape->pressure;
vesicle->pswitch=tape->pswitch;
-
+ if(tape->shc>0){
+ vesicle->sphHarmonics=complex_sph_init(vesicle->vlist,tape->shc);
+ }
+ else {
+ vesicle->sphHarmonics=NULL;
+ }
return vesicle;
}
--
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