steric_1.11
|
Makefile,
Makefile.sgi,
README.steric,
contplot,
craig.c,
craig.h,
crystal.c,
crystal.h,
integrat.c,
integrat.h,
leach.c,
leach.h,
long_steric,
makeit,
mapcont,
mapcont.c,
mapprof,
mapprof.c,
profplot,
proja.c,
proja.h,
ryan.c,
ryan.h,
ryan_perm.c,
ryan_perm.h,
ryan_quad.c,
ryan_quad.h,
steraid.c,
steraid.h,
stercalc.c,
stercalc.h,
stercomm.c,
stercomm.h,
sterdefn.h,
stererr.h,
sterfile.c,
sterfile.h,
stergrap.c,
stergrap.h,
stergrp.c,
stergrp.h,
steric,
steric.TeX,
steric.err,
steric.grp,
steric.hlp,
steric.ini,
steric.par,
stermain.c,
stermem.c,
stermem.h,
sterover.c,
sterover.h,
sterplot,
stertext.c,
stertext.h,
test.bgf,
test.inp,
vectors.c,
vectors.h,
|
|
|
/**************************************************************************/
/**************************************************************************/
/************************** "steric" **********************************/
/**************************************************************************/
/************* Program to calculate ligand cone ********************/
/************* angles as a measure of steric size ********************/
/**************************************************************************/
/**************************************************************************/
/**************************************************************************/
/****************** Graphics Functions **************************/
/**************************************************************************/
/****************** This module is **************************/
/****************** system independant **************************/
/**************************************************************************/
#define X_RAN 80
#define Y_RAN 80 /* x and y range parameters for special view */
#define CONT_SCRIPT "contplot" /* script to plot molecule contour */
#define PROF_SCRIPT "profplot" /* script to plot 3D profile contour */
#define PROJ_RAN 100 /* number of points around each atom is proj. */
int Draw_Steric_Profile(char *args, Mol *molecule, Set *set, char mode);
int Draw_Steric_Parameter(char *args, Mol *molecule, Set *set);
int Draw_Molecule_Contour(Mol *molecule, Set *set,char *script);
int Draw_Special_View(Mol *M, Set *set);
int Draw_Projected_View(Mol *M, Set *set);
/**************************************************************************/
/************************* The End ... ***********************************/
/**************************************************************************/
|