File: forceFieldParameters.sip

package info (click to toggle)
ball 1.5.0%2Bgit20180813.37fc53c-6
  • links: PTS, VCS
  • area: main
  • in suites: bullseye
  • size: 239,888 kB
  • sloc: cpp: 326,149; ansic: 4,208; python: 2,303; yacc: 1,778; lex: 1,099; xml: 958; sh: 322; makefile: 95
file content (20 lines) | stat: -rw-r--r-- 481 bytes parent folder | download | duplicates (4) 
1
2
3
4
5
6
7
8
9
10
11
12
13
14
15
16
17
18
19
20
 
class ForceFieldParameters
	: Parameters
{
%TypeHeaderCode
	#include <BALL/MOLMEC/PARAMETER/forceFieldParameters.h>
%End
	public:

	ForceFieldParameters();
	ForceFieldParameters(const String& filename);
	ForceFieldParameters(const ForceFieldParameters& force_field_parameter);
	virtual ~ForceFieldParameters();
	virtual void clear();
	AtomTypes&	getAtomTypes();

	virtual bool init();

	virtual bool isValid() const;
	bool operator == (const ForceFieldParameters& param) const;
};