src/kernel/pgutil.h

   1 /*
   2  *
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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.
  14
  15  * This program is free software; you can redistribute it and/or
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  35
  36 #ifndef _pgutil_h
  37 #define _pgutil_h
  38
  39 #include "typedefs.h"
  40
  41 extern atom_id search_atom(const char *type,int start,
  42                            int natoms,t_atom at[],
  43                            char ** const * anm,
  44                            const char *bondtype,bool bDontQuit);
  45 /* Search an atom in array of pointers to strings, starting from start
  46  * if type starts with '-' then searches backwards from start.
  47  * bondtype is only used for printing the error/warning string,
  48  * when bondtype="check" no error/warning is issued.
  49  * When bDontQuit=FALSE an fatal error is issued, otherwise a warning.
  50  */
  51
  52 extern void set_at(t_atom *at,real m,real q,int type,int resind);
  53
  54 #endif  /* _pgutil_h */