VinaLC: Parallel Molecular Docking Program

Biochemical and Biophysical Systems Group
VinaLC version: 1.1.2

model.h File Reference
#include <boost/optional.hpp>
#include "file.h"
#include "tree.h"
#include "matrix.h"
#include "precalculate.h"
#include "igrid.h"
#include "grid_dim.h"
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Classes

struct  interacting_pair
 
struct  ligand
 
struct  residue
 
struct  model
 

Typedefs

typedef std::vector
< interacting_pair
interacting_pairs
 
typedef std::pair< std::string,
boost::optional< sz > > 
parsed_line
 
typedef std::vector< parsed_linecontext
 
typedef
strictly_triangular_matrix
< distance_type
distance_type_matrix
 

Enumerations

enum  distance_type { DISTANCE_FIXED, DISTANCE_ROTOR, DISTANCE_VARIABLE }
 

Typedef Documentation

typedef std::pair<std::string, boost::optional<sz> > parsed_line

Enumeration Type Documentation

Enumerator:
DISTANCE_FIXED 
DISTANCE_ROTOR 
DISTANCE_VARIABLE