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/****************************************************************************
* Copyright (C) from 2009 to Present EPAM Systems.
*
* This file is part of Indigo toolkit.
*
* Licensed under the Apache License, Version 2.0 (the "License");
* you may not use this file except in compliance with the License.
* You may obtain a copy of the License at
*
* http://www.apache.org/licenses/LICENSE-2.0
*
* Unless required by applicable law or agreed to in writing, software
* distributed under the License is distributed on an "AS IS" BASIS,
* WITHOUT WARRANTIES OR CONDITIONS OF ANY KIND, either express or implied.
* See the License for the specific language governing permissions and
* limitations under the License.
***************************************************************************/
#ifndef __render_common_h__
#define __render_common_h__
#include "base_cpp/tlscont.h"
#include "graph/graph.h"
#include "layout/metalayout.h"
#include "molecule/elements.h"
#include "reaction/base_reaction.h"
#include "render2d/render_cdxml.h"
typedef void* PVOID;
namespace indigo
{
struct Vec2f;
struct Edge;
class BaseMolecule;
class BaseReaction;
class BaseMolecule;
class Reaction;
class QueryMolecule;
class QueryReaction;
class Output;
enum DINGO_MODE
{
MODE_NONE,
MODE_PDF,
MODE_PNG,
MODE_SVG,
MODE_EMF,
MODE_HDC,
MODE_PRN,
MODE_CDXML
};
enum LABEL_MODE
{
LABEL_MODE_NONE,
LABEL_MODE_HETERO,
LABEL_MODE_TERMINAL_HETERO,
LABEL_MODE_ALL
};
enum STEREO_STYLE
{
STEREO_STYLE_EXT,
STEREO_STYLE_OLD,
STEREO_STYLE_NONE
};
enum
{
CWC_BASE = -2,
CWC_WHITE = 0,
CWC_BLACK,
CWC_RED,
CWC_GREEN,
CWC_BLUE,
CWC_DARKGREEN,
CWC_COUNT
};
enum FONT_SIZE
{
FONT_SIZE_LABEL = 0,
FONT_SIZE_ATTR,
FONT_SIZE_RGROUP_LOGIC,
FONT_SIZE_RGROUP_LOGIC_INDEX,
FONT_SIZE_INDICES,
FONT_SIZE_ATTACHMENT_POINT_INDEX,
FONT_SIZE_RSITE_ATTACHMENT_INDEX,
FONT_SIZE_COMMENT,
FONT_SIZE_TITLE,
FONT_SIZE_DATA_SGROUP,
FONT_SIZE_COUNT /*must be the last*/
};
enum COMMENT_POS
{
COMMENT_POS_TOP,
COMMENT_POS_BOTTOM
};
enum HYDRO_POS
{
HYDRO_POS_RIGHT = 0,
HYDRO_POS_UP,
HYDRO_POS_DOWN,
HYDRO_POS_LEFT
};
// cos(a) to cos(a/2)
double cos2c(const double cs);
// cos(a) to sin(a/2)
double sin2c(const double cs);
// cos(a) to tg(a/2)
double tg2c(const double cs);
// cos(a) to ctg(a/2)
double ctg2c(const double cs);
struct RenderItem
{
enum TYPE
{
RIT_NULL = 0,
RIT_LABEL,
RIT_PSEUDO,
RIT_HYDROGEN,
RIT_HYDROINDEX,
RIT_ISOTOPE,
RIT_CHARGESIGN,
RIT_CHARGEVAL,
RIT_RADICAL,
RIT_STEREOGROUP,
RIT_VALENCE,
RIT_AAM,
RIT_CHIRAL,
RIT_ATTACHMENTPOINT,
RIT_ATOMID,
RIT_TOPOLOGY,
RIT_SGROUP,
RIT_DATASGROUP,
RIT_COMMENT,
RIT_TITLE
};
RenderItem();
void clear();
TYPE ritype;
Vec2f bbp; // a point to draw the text from
Vec2f bbsz; // width and height of the text
Vec2f relpos; // text bearing (positive if text is entirely on the
// right and bottom from the bbp point)
int color;
bool highlighted;
bool noBondOffset;
};
struct TextItem : public RenderItem
{
TextItem()
{
clear();
}
void clear();
Array<char> text;
FONT_SIZE fontsize;
};
struct GraphItem : public RenderItem
{
enum TYPE
{
DOT,
CAP,
PLUS,
MINUS
};
GraphItem()
{
clear();
}
void clear();
TYPE type;
};
struct RenderItemBracket : public RenderItem
{
RenderItemBracket()
{
clear();
}
void clear();
Vec2f p0, p1, q0, q1, d, n;
float width, length;
bool invertUpperLowerIndex;
};
struct RenderItemAttachmentPoint : public RenderItem
{
RenderItemAttachmentPoint()
{
clear();
}
void clear();
int number;
Vec2f p0, p1, dir;
};
struct RenderItemRSiteAttachmentIndex : public RenderItem
{
RenderItemRSiteAttachmentIndex()
{
clear();
}
void clear();
int number;
float radius;
};
struct AtomDesc
{
enum TYPE
{
TYPE_REGULAR,
TYPE_PSEUDO,
TYPE_QUERY
};
AtomDesc();
void clear();
int tibegin, ticount;
int gibegin, gicount;
int attachmentPointBegin, attachmentPointCount;
int rSiteAttachmentIndexBegin, rSiteAttachmentIndexCount;
int type;
bool showLabel;
bool showHydro;
HYDRO_POS hydroPos;
bool isRGroupAttachmentPoint;
bool fixed;
bool exactChange;
bool pseudoAtomStringVerbose;
Vec2f pos;
Vec2f boundBoxMin;
Vec2f boundBoxMax;
Vec3f hcolor;
bool hcolorSet;
int label;
int queryLabel;
int color;
int stereoGroupType;
int stereoGroupNumber;
int implicit_h;
Array<int> list;
Array<char> pseudo;
Array<int> nearbyAtoms;
int aam;
int inversion;
float implHPosWeights[4];
float upperSin, lowerSin, rightSin, leftSin;
float leftMargin, rightMargin, ypos, height;
private:
AtomDesc(const AtomDesc& ad);
};
struct Sgroup
{
Sgroup();
void clear();
int tibegin, ticount;
int gibegin, gicount;
int bibegin, bicount;
private:
Sgroup(const SGroup& sg);
};
struct BondEnd
{
BondEnd();
void clear();
Vec2f dir;
Vec2f lnorm;
Vec2f p; // corrected position
float rcos;
float rsin;
// these are bond end ids in the _data.bondend array, NOT neighbor indices in the molecule!
int rnei;
int lnei;
float rang;
float lcos;
float lsin;
int next;
float lang;
bool centered;
int aid;
int bid;
float offset;
bool prolong;
int lRing;
float width;
private:
BondEnd(const BondEnd& be);
};
struct BondDescr : public Edge
{
BondDescr();
DECL_ERROR;
void clear();
int getBondEnd(int aid) const;
Vec2f norm, dir, vb, ve, center;
float thickness;
float bahs, eahs;
bool inRing;
bool aromRing;
bool stereoCare;
bool centered;
bool lineOnTheRight;
bool isShort;
int stereodir;
bool cistrans;
int type;
int queryType;
float length;
int be1, be2;
float extP, extN;
int tiTopology;
int topology;
int reactingCenter;
private:
BondDescr(const BondDescr& bd);
};
struct Ring
{
Ring();
void clear();
Array<int> bondEnds;
Array<float> angles;
int dblBondCount;
bool aromatic;
Vec2f center;
float radius;
private:
Ring(const Ring& r);
};
struct MoleculeRenderData
{
MoleculeRenderData();
void clear();
ObjArray<Sgroup> sgroups;
ObjArray<AtomDesc> atoms;
ObjArray<BondDescr> bonds;
ObjArray<Ring> rings;
ObjArray<BondEnd> bondends;
ObjArray<TextItem> textitems;
ObjArray<GraphItem> graphitems;
ObjArray<RenderItemAttachmentPoint> attachmentPoints;
ObjArray<RenderItemRSiteAttachmentIndex> rSiteAttachmentIndices;
ObjArray<RenderItemBracket> brackets;
Array<int> aam;
Array<int> reactingCenters;
Array<int> inversions;
Array<int> exactChanges;
private:
MoleculeRenderData(const MoleculeRenderData& data);
};
class RenderSettings
{
public:
RenderSettings();
void init(float sf, float lwf);
CP_DECL;
TL_CP_DECL(Array<double>, bondDashAromatic);
TL_CP_DECL(Array<double>, bondDashAny);
TL_CP_DECL(Array<double>, bondDashSingleOrAromatic);
TL_CP_DECL(Array<double>, bondDashDoubleOrAromatic);
float labelInternalOffset;
float lowerIndexShift;
float unit;
float bondLineWidth;
float bondSpace;
float boundExtent;
float upperIndexShift;
float radicalRightOffset;
float radicalRightVertShift;
float radicalTopOffset;
float radicalTopDistDot;
float radicalTopDistCap;
float stereoGroupLabelOffset;
float dashUnit;
float eps;
float stereoCareBoxSize;
float cosineTreshold;
float prolongAdjSinTreshold;
float minBondLength;
float graphItemDotRadius;
float graphItemCapSlope;
float graphItemCapBase;
float graphItemCapWidth;
float graphItemDigitWidth;
float graphItemDigitHeight;
float graphItemSignLineWidth;
float graphItemPlusEdge;
float fzz[FONT_SIZE_COUNT];
// Layout params, relative to average bond length units
float layoutMarginHorizontal;
float layoutMarginVertical;
float plusSize;
float metaLineWidth;
float arrowLength;
float arrowHeadWidth;
float arrowHeadSize;
float equalityInterval;
float rGroupIfThenInterval;
float neighboringLabelTolerance;
float minSin;
float neighboringAtomDistanceTresholdA;
float neighboringAtomDistanceTresholdB;
private:
RenderSettings(const RenderSettings& settings);
};
struct MultilineTextLayout
{
enum Alignment
{
Left,
Right,
Center
};
MultilineTextLayout();
MultilineTextLayout(Alignment bbox, Alignment inbox);
// Text can be aligned in different ways: left, right, center. But if text has multiple
// lines then this lines can also be aligned in different ways relative to each other
// +-----------------------------------+--------------+
// | View | Type |
// +===================================+==============+
// | Line | left |
// | Quite Long line | |
// +-----------------------------------+--------------+
// | Line | right |
// | Quite Long line | |
// +-----------------------------------+--------------+
// | Line | center |
// | Quite a Long line | |
// +-----------------------------------+--------------+
// | Line | center-left |
// | Quite a Long line | |
// +-----------------------------------+--------------+
// Alignment of the bounding box
Alignment bbox_alignment;
// Text alignment insdie bounding box
Alignment inbox_alignment;
void clear();
// Returns values from 0.0 to 1.0 depending on the title box alignment
float getBboxRelativeOffset() const;
float getInboxRelativeOffset() const;
static float getRelativeOffset(Alignment alignment);
float getAnchorPoint(float area_x, float area_width, float text_width);
};
struct CanvasOptions
{
CanvasOptions();
void clear();
int width;
int height;
int maxWidth;
int maxHeight;
int xOffset;
int yOffset;
float bondLength;
int gridMarginX;
int gridMarginY;
int marginX;
int marginY;
int commentOffset;
int titleOffset;
Array<char> comment;
Array<char> titleProp;
COMMENT_POS commentPos;
MultilineTextLayout commentAlign;
MultilineTextLayout titleAlign;
int gridColumnNumber;
private:
CanvasOptions(const CanvasOptions&);
};
class RenderOptions
{
public:
RenderOptions();
void clear();
Vec3f backgroundColor;
Vec3f baseColor;
bool highlightThicknessEnable;
float highlightThicknessFactor;
bool highlightColorEnable;
Vec3f highlightColor;
Vec3f aamColor;
float commentFontFactor;
float commentSpacing;
float titleFontFactor;
float titleSpacing;
Vec3f commentColor;
Vec3f titleColor;
Vec3f dataGroupColor;
LABEL_MODE labelMode;
bool highlightedLabelsVisible;
bool boldBondDetection;
bool implHVisible;
DINGO_MODE mode;
Output* output;
PVOID hdc;
bool showBondIds;
bool showBondEndIds;
bool atomBondIdsFromOne;
bool showNeighborArcs;
bool showAtomIds;
bool showValences;
bool atomColoring;
STEREO_STYLE stereoMode;
bool showReactingCenterUnchanged;
bool centerDoubleBondWhenStereoAdjacent;
bool showCycles; // for diagnostic purposes
bool agentsBelowArrow;
bool collapseSuperatoms;
Array<char> atomColorProp;
AutoPtr<RenderCdxmlContext> cdxml_context;
private:
RenderOptions(const RenderOptions&);
};
} // namespace indigo
#define QUERY_MOL_BEGIN(mol) \
if (mol->isQueryMolecule()) \
{ \
QueryMolecule& qmol = mol->asQueryMolecule()
#define QUERY_MOL_END }
#define QUERY_RXN_BEGIN1(rxn) \
if (rxn->isQueryReaction()) \
{ \
QueryReaction& qr = rxn->asQueryReaction()
#define QUERY_RXN_BEGIN \
if (_r->isQueryReaction()) \
{ \
QueryReaction& qr = _r->asQueryReaction()
#define QUERY_RXN_END }
#endif //__render_common_h__
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