Open Babel: patty.h File Reference

Classes | Namespaces | Defines

# patty.h File Reference

Programmable atom typer. (abbreviated P.At.Ty.) More...

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## Classes
class | patty
| Programmable Atom Typer. More...
## Namespaces
namespace | OpenBabel
## Defines
#define | PT_CATION 1
#define | PT_ANION 2
#define | PT_ACCEPTOR 3
#define | PT_POLAR 4
#define | PT_DONOR 5
#define | PT_HYDROPHOBIC 6
#define | PT_OTHER 7
#define | PT_METAL 8

## Detailed Description

Programmable atom typer. (abbreviated P.At.Ty.)

## Define Documentation

#define PT_CATION 1

Referenced by patty::type_to_int().

#define PT_ANION 2

Referenced by patty::type_to_int().

#define PT_ACCEPTOR 3

Referenced by patty::type_to_int().

#define PT_POLAR 4

Referenced by patty::type_to_int().

#define PT_DONOR 5

Referenced by patty::type_to_int().

#define PT_HYDROPHOBIC 6

Referenced by patty::type_to_int().

#define PT_OTHER 7

Referenced by patty::type_to_int().

#define PT_METAL 8

Referenced by patty::type_to_int().

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