mirror of
https://github.com/schrodinger/pymol-open-source.git
synced 2026-06-04 20:04:21 +08:00
86 lines
2.8 KiB
C++
86 lines
2.8 KiB
C++
|
|
/*
|
|
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_ObjectSurface
|
|
#define _H_ObjectSurface
|
|
|
|
#include"os_gl.h"
|
|
#include"ObjectMap.h"
|
|
#include"Result.h"
|
|
#include"CGO.h"
|
|
#include"PyMOLEnums.h"
|
|
|
|
struct ObjectSurfaceState : public CObjectState
|
|
{
|
|
ObjectNameType MapName;
|
|
int MapState;
|
|
CCrystal Crystal;
|
|
int Active = false;
|
|
pymol::vla<int> N;
|
|
int nT = 0;
|
|
int base_n_V;
|
|
pymol::vla<float> V;
|
|
std::vector<float> VC;
|
|
std::vector<int> RC;
|
|
int OneColor;
|
|
int VCsize() { return VC.size() / 3; }
|
|
int Range[6];
|
|
float ExtentMin[3], ExtentMax[3];
|
|
int ExtentFlag = false;
|
|
float Level, Radius;
|
|
int RefreshFlag;
|
|
int ResurfaceFlag = true;
|
|
int RecolorFlag = false;
|
|
int quiet = true;
|
|
pymol::vla<float> AtomVertex;
|
|
int CarveFlag = false;
|
|
float CarveBuffer;
|
|
cIsosurfaceMode Mode;
|
|
int DotFlag;
|
|
pymol::cache_ptr<CGO> UnitCellCGO;
|
|
pymol::cache_ptr<CGO> UnitCellShaderCGO;
|
|
cIsosurfaceSide Side = cIsosurfaceSide::front;
|
|
pymol::cache_ptr<CGO> shaderCGO;
|
|
ObjectSurfaceState(PyMOLGlobals* G);
|
|
};
|
|
|
|
struct ObjectSurface : public pymol::CObject {
|
|
std::vector<ObjectSurfaceState> State;
|
|
ObjectSurface(PyMOLGlobals* G);
|
|
|
|
// virtual methods
|
|
void update() override;
|
|
void render(RenderInfo* info) override;
|
|
void invalidate(cRep_t rep, cRepInv_t level, int state) override;
|
|
int getNFrame() const override;
|
|
pymol::CObject* clone() const override;
|
|
};
|
|
|
|
ObjectSurface *ObjectSurfaceFromBox(PyMOLGlobals * G, ObjectSurface * obj,
|
|
ObjectMap * map, int map_state, int state, float *mn,
|
|
float *mx, float level, cIsosurfaceMode, float carve,
|
|
pymol::vla<float>&& vert_vla, cIsosurfaceSide, int quiet);
|
|
void ObjectSurfaceDump(ObjectSurface * I, const char *fname, int state, int quiet);
|
|
|
|
int ObjectSurfaceNewFromPyList(PyMOLGlobals * G, PyObject * list,
|
|
ObjectSurface ** result);
|
|
PyObject *ObjectSurfaceAsPyList(ObjectSurface * I);
|
|
int ObjectSurfaceSetLevel(ObjectSurface * I, float level, int state, int quiet);
|
|
pymol::Result<float> ObjectSurfaceGetLevel(ObjectSurface * I, int state);
|
|
int ObjectSurfaceInvalidateMapName(ObjectSurface * I, const char *name, const char * new_name);
|
|
|
|
#endif
|