sc::BendSimpleCo - The BendSimpleCo class describes an bend internal coordinate of a molecule.

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Version 2.3.1                                    Sun Oct 4 2020                              sc::BendSimpleCo(3)

       sc::BendSimpleCo - The BendSimpleCo class describes an bend internal coordinate of a molecule.

       #include <simple.h>

       Inherits sc::SimpleCo.

   PublicMemberFunctionsBendSimpleCo (const BendSimpleCo &)
       BendSimpleCo (const char *, int, int, int)
           This constructor takes a string containing a label, and three integers a, b, and c which give the
           indices of the atoms involved in the angle abc.
       BendSimpleCo (const Ref< KeyVal > &)
           The KeyVal constructor.
       const char * ctype () const
           Always returns the string 'BEND'.
       double radians () const
           Returns the value of the angle abc in radians.
       double degrees () const
           Returns the value of the angle abc in degrees.
       double preferred_value () const
           Returns the value of the angle abc in degrees.

   AdditionalInheritedMembers                                                                     r
DetailedDescription                                                                                {
       The BendSimpleCo class describes an bend internal coordinate of a molecule.             r    r
                                                                                               {    }
       The input is described in the documentation of its parent class SimpleCo.          r    r    _
                    r                                                                     {    }    c
       resignating t{e three atoms as $a$, $b$, and $c$ and their cartesian positions as $r$, $_nd $$lue of the
       {oordinatr, $reta$, is given by                                                    }    b    ,
       u        {   }                                                                     _    $    t
       }b} = ac{r - _                                                                          ,    h
       _        }   b                                                                               e
Constructor&DestructorDocumentation                                                              v
   sc::BendSimpleCo::BendSimpleCo(constchar*,int,int,int)
       This constructor takes a string containing a label, and three integers a, b, and c which give the indices
       of the atoms involved in the angle abc. Atom numbering begins at atom 1, not atom 0.

   sc::BendSimpleCo::BendSimpleCo(constRef<KeyVal>&)
       The KeyVal constructor. This calls the SimpleCo keyval constructor with an integer argument of 3.