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Merge remote-tracking branch 'origin/master' into refactor-table-reading

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Richard Berger
2020-06-05 16:41:05 -04:00
parent 2203e1e9e5 12386945d5
commit 4f804f58e3
55 changed files with 587 additions and 867 deletions
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38
src/force.h
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@ -101,32 +101,32 @@ class Force : protected Pointers {
void init();
void setup();
void create_pair(const char *, int);
class Pair *new_pair(const char *, int, int &);
class Pair *pair_match(const char *, int, int nsub=0);
void create_pair(const std::string &, int);
class Pair *new_pair(const std::string &, int, int &);
class Pair *pair_match(const std::string &, int, int nsub=0);
char *pair_match_ptr(Pair *);
void create_bond(const char *, int);
class Bond *new_bond(const char *, int, int &);
class Bond *bond_match(const char *);
void create_bond(const std::string &, int);
class Bond *new_bond(const std::string &, int, int &);
class Bond *bond_match(const std::string &);
void create_angle(const char *, int);
class Angle *new_angle(const char *, int, int &);
class Angle *angle_match(const char *);
void create_angle(const std::string &, int);
class Angle *new_angle(const std::string &, int, int &);
class Angle *angle_match(const std::string &);
void create_dihedral(const char *, int);
class Dihedral *new_dihedral(const char *, int, int &);
class Dihedral *dihedral_match(const char *);
void create_dihedral(const std::string &, int);
class Dihedral *new_dihedral(const std::string &, int, int &);
class Dihedral *dihedral_match(const std::string &);
void create_improper(const char *, int);
class Improper *new_improper(const char *, int, int &);
class Improper *improper_match(const char *);
void create_improper(const std::string &, int);
class Improper *new_improper(const std::string &, int, int &);
class Improper *improper_match(const std::string &);
void create_kspace(const char *, int);
class KSpace *new_kspace(const char *, int, int &);
class KSpace *kspace_match(const char *, int);
void create_kspace(const std::string &, int);
class KSpace *new_kspace(const std::string &, int, int &);
class KSpace *kspace_match(const std::string &, int);
void store_style(char *&, const char *, int);
void store_style(char *&, const std::string &, int);
void set_special(int, char **);
void bounds(const char *, int, char *, int, int &, int &, int nmin=1);
void boundsbig(const char *, int, char *, bigint, bigint &, bigint &, bigint nmin=1);