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update colvars library to version 2014-10-23

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This commit is contained in:
Axel Kohlmeyer
2014-10-23 17:45:03 +02:00
parent c47c1428c2
commit fa7b086390
13 changed files with 185 additions and 33 deletions
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45
lib/colvars/colvarvalue.cpp
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@ -214,6 +214,51 @@ void colvarvalue::p2leg_opt(colvarvalue const &x,
};
}
std::string colvarvalue::to_simple_string() const
{
switch (type()) {
case colvarvalue::type_scalar:
return cvm::to_str(real_value, 0, cvm::cv_prec);
break;
case colvarvalue::type_vector:
case colvarvalue::type_unitvector:
case colvarvalue::type_unitvectorderiv:
return rvector_value.to_simple_string();
break;
case colvarvalue::type_quaternion:
case colvarvalue::type_quaternionderiv:
return quaternion_value.to_simple_string();
break;
case colvarvalue::type_notset:
undef_op();
break;
}
return std::string();
}
int colvarvalue::from_simple_string(std::string const &s)
{
switch (type()) {
case colvarvalue::type_scalar:
return ((std::istringstream(s) >> real_value)
? COLVARS_OK : COLVARS_ERROR);
break;
case colvarvalue::type_vector:
case colvarvalue::type_unitvector:
case colvarvalue::type_unitvectorderiv:
return rvector_value.from_simple_string(s);
break;
case colvarvalue::type_quaternion:
case colvarvalue::type_quaternionderiv:
return quaternion_value.from_simple_string(s);
break;
case colvarvalue::type_notset:
break;
default:
undef_op();
}
return COLVARS_ERROR;
}
std::ostream & operator << (std::ostream &os, colvarvalue const &x)
{