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root/freemol/trunk/smi23d/src/mengine/fix.h
Revision: 3
Committed: Mon Jun 9 21:38:26 2008 UTC (11 years, 4 months ago) by tjod
File size: 541 byte(s)
Log Message:
test

Line File contents
1 // fix distantce data
2
3 #define MAXDIS 300
4
5 EXTERN struct t_fixdis {
6 int FixBond;
7 int nfxstr, ifxstr[MAXDIS][2];
8 float fxstrd[MAXDIS], fxstrc[MAXDIS];
9 int fixatm;
10 } fixdis;
11
12 // fix angle data
13 EXTERN struct t_fixangle {
14 int nfxangle, ifxangle[10][3];
15 float anat[10], acon[10];
16 } fixangle;
17
18 // fix torsion data
19 EXTERN struct t_fxtor {
20 int nfxtor, iatom[10][4];
21 int start_ang[10], curr_ang[10], final_ang[10];
22 int step[10];
23 } fxtor;