1
2
3
4
5
6
7
8
9
10
11
12
13
14
15
16
17
18
19
20
21
22
23
24
25
26
27
28
29
30
31
32
33
34
35
36
37
38
39
40
41
42
43
44
45
46
47
48
49
50
51
52
53
54
55
56
57
58
59
60
61
62
63
64
65
66
67
68
69
|
/*
A* -------------------------------------------------------------------
B* This file contains source code for the PyMOL computer program
C* copyright 1998-2000 by Warren Lyford Delano of DeLano Scientific.
D* -------------------------------------------------------------------
E* It is unlawful to modify or remove this copyright notice.
F* -------------------------------------------------------------------
G* Please see the accompanying LICENSE file for further information.
H* -------------------------------------------------------------------
I* Additional authors of this source file include:
-*
-*
-*
Z* -------------------------------------------------------------------
*/
#ifndef _H_ObjectDist
#define _H_ObjectDist
#include "PyMOLObject.h"
#include "vla.h"
struct DistSet;
/* NOTE: "Dist" names & symbols should be updated to "Measurement" */
struct ObjectDist : public CObject {
pymol::vla<DistSet*> DSet;
int NDSet = 0;
ObjectDist(PyMOLGlobals* G);
~ObjectDist();
// virtual methods
void update() override;
void render(RenderInfo* info) override;
void invalidate(int rep, int level, int state) override;
int getNFrame() const override;
};
ObjectDist *ObjectDistNewFromSele(PyMOLGlobals * G, ObjectDist * oldObj,
int sele1, int sele2, int mode, float cutoff,
int labels, int reset, float *result, int state,
int state1, int state2);
ObjectDist *ObjectDistNewFromAngleSele(PyMOLGlobals * G, ObjectDist * oldObj,
int sele1, int sele2, int sele3, int mode,
int labels, float *result, int reset, int state,
int state1, int state2, int state3);
ObjectDist *ObjectDistNewFromDihedralSele(PyMOLGlobals * G, ObjectDist * oldObj,
int sele1, int sele2, int sele3, int sele4,
int mode, int labels, float *result,
int reset, int state);
int ObjectDistGetLabelTxfVertex(ObjectDist * I, int state, int index, float *v);
int ObjectDistMoveLabel(ObjectDist * I, int state, int index, float *v, int mode,
int log);
void ObjectDistInvalidateRep(ObjectDist * I, int rep);
PyObject *ObjectDistAsPyList(ObjectDist * I);
int ObjectDistNewFromPyList(PyMOLGlobals * G, PyObject * list, ObjectDist ** result);
/* -- JV -- dyndist */
/* An ObjectMolecule moved, causing this function to be called */
struct ObjectMolecule;
int ObjectDistMoveWithObject(ObjectDist * I, struct ObjectMolecule * O);
#endif
|
