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root/freemol/branches/sync4pymol12/src/mengine/src/derivs.h
Revision: 93
Committed: Sat Jan 17 23:24:55 2009 UTC (13 years, 4 months ago) by wdelano
File size: 604 byte(s)
Log Message:
branch created
Line File contents
1 /* EXTERN struct t_deriv {
2 double d1[MAXATOM][3],
3 deb[MAXATOM][3], dea[MAXATOM][3], destb[MAXATOM][3],deopb[MAXATOM][3],
4 detor[MAXATOM][3],de14[MAXATOM][3], devdw[MAXATOM][3],deqq[MAXATOM][3],
5 deaa[MAXATOM][3], destor[MAXATOM][3], dehb[MAXATOM][3], deimprop[MAXATOM][3];
6 } deriv; */
7
8 EXTERN struct t_deriv {
9 double **d1,
10 **deb, **dea, **destb, **deopb, **detor,**de14, **devdw, **deqq,
11 **deaa, **destor, **dehb, **deimprop, **deub, **desolv, *drb, **degeom;
12 } deriv;
13