From 621830b501728adb038b37281bd23d678a3c053d Mon Sep 17 00:00:00 2001 From: Samo Penic <samo.penic@fe.uni-lj.si> Date: Thu, 07 Jun 2012 12:15:54 +0000 Subject: [PATCH] Moved Ylmi into vertex_ts datastructure, since it is vertex related --- src/general.h | 35 +++++++++++++++++++++++++++++++++++ 1 files changed, 35 insertions(+), 0 deletions(-) diff --git a/src/general.h b/src/general.h index aff7680..2fe0ee2 100644 --- a/src/general.h +++ b/src/general.h @@ -110,6 +110,23 @@ /* STRUCTURES */ + +/** @brief Data structure for keeping the coordinates in selected coordinate + * system + */ +#define TS_COORD_CARTESIAN 0 +#define TS_COORD_SPHERICAL 1 +#define TS_COORD_CYLINDRICAL 2 + +typedef struct { + ts_double e1; + ts_double e2; + ts_double e3; + ts_uint coord_type; +} ts_coord; + + + /** @brief Data structure of all data connected to a vertex * * ts_vertex holds the data for one single point (bead, vertex). To understand how to use it @@ -134,6 +151,10 @@ ts_double xk; ts_double c; ts_uint id; + ts_double **Ylm; + ts_double projArea; + ts_double relR; + ts_double solAngle; }; typedef struct ts_vertex ts_vertex; @@ -166,6 +187,7 @@ ts_double xnorm; ts_double ynorm; ts_double znorm; + ts_double area; // firstly needed for sh.c }; typedef struct ts_triangle ts_triangle; @@ -193,6 +215,15 @@ typedef struct { + ts_uint l; + ts_uint i; + ts_double **ulm; + ts_double **co; +} ts_spharm; + + + +typedef struct { ts_vertex_list *vlist; ts_bond_list *blist; ts_triangle_list *tlist; @@ -202,9 +233,13 @@ ts_double dmax; ts_double stepsize; ts_double cm[3]; + ts_double volume; + ts_spharm *sphHarmonics; } ts_vesicle; + + /* GLOBAL VARIABLES */ int quiet; -- Gitblit v1.9.3