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root/freemol/trunk/src/mengine/src/dipmom.h
Revision: 103
Committed: Thu Feb 19 01:37:38 2009 UTC (12 years, 4 months ago) by gilbertke
File size: 119 byte(s)
Log Message:
major rewrite - removing global data, adding electrostatics tag to read_sdf
Line File contents
1 struct t_dipolemom {
2 double total, xdipole, ydipole, zdipole;
3 } dipolemom;
4
5
6 void charge_dipole(void);