include/gen_ad.h

   1 /*
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   9  *                        VERSION 3.2.0
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  12  * Copyright (c) 2001-2004, The GROMACS development team,
  13  * check out http://www.gromacs.org for more information.
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  15  * This program is free software; you can redistribute it and/or
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  35
  36 #ifndef _gen_ad_h
  37 #define _gen_ad_h
  38
  39 #include "typedefs.h"
  40 #include "toputil.h"
  41 #include "gpp_nextnb.h"
  42 #include "resall.h"
  43
  44 #ifdef __cplusplus
  45 extern "C" {
  46 #endif
  47
  48 void generate_excls(t_nextnb *nnb, int nrexcl, t_excls excls[]);
  49 void clean_excls(t_nextnb *nnb, int nrexcl, t_excls excls[]);
  50
  51 void gen_pad(t_nextnb *nnb, t_atoms *atoms, int nrexcl, gmx_bool bH14,
  52                     t_params plist[], t_excls excls[], t_hackblock hb[],
  53                     gmx_bool bAlldih, gmx_bool bRemoveDih, gmx_bool bAllowMissing);
  54
  55 #ifdef __cplusplus
  56 }
  57 #endif
  58
  59 #endif  /* _gen_ad_h */