mirror of
https://github.com/rdkit/rdkit.git
synced 2026-06-04 21:54:27 +08:00
* remove a bunch of compiler warnings * remove some more warnings on windows (there are still plenty to go...)
227 lines
7.2 KiB
C++
227 lines
7.2 KiB
C++
//
|
|
// Copyright (C) 2015 Greg Landrum
|
|
//
|
|
// @@ All Rights Reserved @@
|
|
// This file is part of the RDKit.
|
|
// The contents are covered by the terms of the BSD license
|
|
// which is included in the file license.txt, found at the root
|
|
// of the RDKit source tree.
|
|
//
|
|
// derived from Dave Cosgrove's MolDraw2D
|
|
//
|
|
|
|
#include "MolDraw2DCairo.h"
|
|
#include <cairo.h>
|
|
|
|
namespace RDKit {
|
|
void MolDraw2DCairo::initDrawing() {
|
|
PRECONDITION(dp_cr, "no draw context");
|
|
cairo_select_font_face(dp_cr, "sans", CAIRO_FONT_SLANT_NORMAL,
|
|
CAIRO_FONT_WEIGHT_NORMAL);
|
|
cairo_set_line_cap(dp_cr, CAIRO_LINE_CAP_BUTT);
|
|
}
|
|
|
|
// ****************************************************************************
|
|
void MolDraw2DCairo::finishDrawing() {}
|
|
|
|
// ****************************************************************************
|
|
void MolDraw2DCairo::setColour(const DrawColour &col) {
|
|
PRECONDITION(dp_cr, "no draw context");
|
|
MolDraw2D::setColour(col);
|
|
cairo_set_source_rgb(dp_cr, col.get<0>(), col.get<1>(), col.get<2>());
|
|
}
|
|
|
|
// ****************************************************************************
|
|
void MolDraw2DCairo::drawLine(const Point2D &cds1, const Point2D &cds2) {
|
|
PRECONDITION(dp_cr, "no draw context");
|
|
Point2D c1 = getDrawCoords(cds1);
|
|
Point2D c2 = getDrawCoords(cds2);
|
|
|
|
unsigned int width = lineWidth();
|
|
std::string dashString = "";
|
|
|
|
cairo_set_line_width(dp_cr, width);
|
|
|
|
const DashPattern &dashes = dash();
|
|
if (dashes.size()) {
|
|
double *dd = new double[dashes.size()];
|
|
std::copy(dashes.begin(), dashes.end(), dd);
|
|
cairo_set_dash(dp_cr, dd, dashes.size(), 0);
|
|
delete[] dd;
|
|
} else {
|
|
cairo_set_dash(dp_cr, nullptr, 0, 0);
|
|
}
|
|
|
|
cairo_move_to(dp_cr, c1.x, c1.y);
|
|
cairo_line_to(dp_cr, c2.x, c2.y);
|
|
cairo_stroke(dp_cr);
|
|
}
|
|
|
|
void MolDraw2DCairo::drawWavyLine(const Point2D &cds1, const Point2D &cds2,
|
|
const DrawColour &col1,
|
|
const DrawColour &col2,
|
|
unsigned int nSegments, double vertOffset) {
|
|
PRECONDITION(dp_cr, "no draw context");
|
|
PRECONDITION(nSegments > 1, "too few segments");
|
|
RDUNUSED_PARAM(col2);
|
|
|
|
if (nSegments % 2)
|
|
++nSegments; // we're going to assume an even number of segments
|
|
|
|
Point2D perp = calcPerpendicular(cds1, cds2);
|
|
Point2D delta = (cds2 - cds1);
|
|
perp *= vertOffset;
|
|
delta /= nSegments;
|
|
|
|
Point2D c1 = getDrawCoords(cds1);
|
|
|
|
unsigned int width = lineWidth();
|
|
cairo_set_line_width(dp_cr, width);
|
|
cairo_set_dash(dp_cr, nullptr, 0, 0);
|
|
setColour(col1);
|
|
cairo_move_to(dp_cr, c1.x, c1.y);
|
|
for (unsigned int i = 0; i < nSegments; ++i) {
|
|
Point2D startpt = cds1 + delta * i;
|
|
Point2D segpt = getDrawCoords(startpt + delta);
|
|
Point2D cpt1 =
|
|
getDrawCoords(startpt + delta / 3. + perp * (i % 2 ? -1 : 1));
|
|
Point2D cpt2 =
|
|
getDrawCoords(startpt + delta * 2. / 3. + perp * (i % 2 ? -1 : 1));
|
|
// if (i == nSegments / 2 && col2 != col1) setColour(col2);
|
|
cairo_curve_to(dp_cr, cpt1.x, cpt1.y, cpt2.x, cpt2.y, segpt.x, segpt.y);
|
|
}
|
|
cairo_stroke(dp_cr);
|
|
}
|
|
|
|
// ****************************************************************************
|
|
// draw the char, with the bottom left hand corner at cds
|
|
void MolDraw2DCairo::drawChar(char c, const Point2D &cds) {
|
|
PRECONDITION(dp_cr, "no draw context");
|
|
char txt[2];
|
|
txt[0] = c;
|
|
txt[1] = 0;
|
|
|
|
cairo_text_extents_t extents;
|
|
cairo_text_extents(dp_cr, txt, &extents);
|
|
Point2D c1 = cds;
|
|
cairo_move_to(dp_cr, c1.x, c1.y);
|
|
cairo_show_text(dp_cr, txt);
|
|
cairo_stroke(dp_cr);
|
|
}
|
|
|
|
// ****************************************************************************
|
|
void MolDraw2DCairo::drawPolygon(const std::vector<Point2D> &cds) {
|
|
PRECONDITION(dp_cr, "no draw context");
|
|
PRECONDITION(cds.size() >= 3, "must have at least three points");
|
|
|
|
cairo_line_cap_t olinecap = cairo_get_line_cap(dp_cr);
|
|
cairo_line_join_t olinejoin = cairo_get_line_join(dp_cr);
|
|
|
|
cairo_set_line_cap(dp_cr, CAIRO_LINE_CAP_BUTT);
|
|
cairo_set_line_join(dp_cr, CAIRO_LINE_JOIN_BEVEL);
|
|
cairo_set_line_width(dp_cr, lineWidth());
|
|
cairo_set_dash(dp_cr, nullptr, 0, 0);
|
|
|
|
for (unsigned int i = 0; i < cds.size(); ++i) {
|
|
Point2D lc = getDrawCoords(cds[i]);
|
|
if (!i)
|
|
cairo_move_to(dp_cr, lc.x, lc.y);
|
|
else
|
|
cairo_line_to(dp_cr, lc.x, lc.y);
|
|
}
|
|
|
|
cairo_close_path(dp_cr);
|
|
if (fillPolys()) cairo_fill_preserve(dp_cr);
|
|
cairo_stroke(dp_cr);
|
|
cairo_set_line_cap(dp_cr, olinecap);
|
|
cairo_set_line_join(dp_cr, olinejoin);
|
|
}
|
|
|
|
// ****************************************************************************
|
|
void MolDraw2DCairo::clearDrawing() {
|
|
PRECONDITION(dp_cr, "no draw context");
|
|
setColour(drawOptions().backgroundColour);
|
|
cairo_rectangle(dp_cr, 0, 0, width(), height());
|
|
cairo_fill(dp_cr);
|
|
}
|
|
|
|
// ****************************************************************************
|
|
void MolDraw2DCairo::setFontSize(double new_size) {
|
|
PRECONDITION(dp_cr, "no draw context");
|
|
MolDraw2D::setFontSize(new_size);
|
|
double font_size_in_points = fontSize() * scale();
|
|
cairo_set_font_size(dp_cr, font_size_in_points);
|
|
}
|
|
|
|
// ****************************************************************************
|
|
// using the current scale, work out the size of the label in molecule
|
|
// coordinates
|
|
void MolDraw2DCairo::getStringSize(const std::string &label,
|
|
double &label_width,
|
|
double &label_height) const {
|
|
PRECONDITION(dp_cr, "no draw context");
|
|
label_width = 0.0;
|
|
label_height = 0.0;
|
|
|
|
TextDrawType draw_mode = TextDrawNormal;
|
|
|
|
bool had_a_super = false;
|
|
|
|
char txt[2];
|
|
txt[1] = 0;
|
|
for (int i = 0, is = label.length(); i < is; ++i) {
|
|
// setStringDrawMode moves i along to the end of any <sub> or <sup>
|
|
// markup
|
|
if ('<' == label[i] && setStringDrawMode(label, draw_mode, i)) {
|
|
continue;
|
|
}
|
|
|
|
txt[0] = label[i];
|
|
cairo_text_extents_t extents;
|
|
cairo_text_extents(dp_cr, txt, &extents);
|
|
double twidth = extents.x_advance, theight = extents.height;
|
|
|
|
label_height = std::max(label_height, theight / scale());
|
|
double char_width = twidth / scale();
|
|
|
|
if (TextDrawSubscript == draw_mode) {
|
|
char_width *= 0.75;
|
|
} else if (TextDrawSuperscript == draw_mode) {
|
|
char_width *= 0.75;
|
|
had_a_super = true;
|
|
}
|
|
label_width += char_width;
|
|
}
|
|
|
|
// subscript keeps its bottom in line with the bottom of the bit chars,
|
|
// superscript goes above the original char top by a quarter
|
|
if (had_a_super) {
|
|
label_height *= 1.25;
|
|
}
|
|
label_height *= 1.2; // empirical
|
|
}
|
|
|
|
namespace {
|
|
cairo_status_t grab_str(void *closure, const unsigned char *data,
|
|
unsigned int len) {
|
|
std::string *str_ptr = (std::string *)closure;
|
|
(*str_ptr) += std::string((const char *)data, len);
|
|
return CAIRO_STATUS_SUCCESS;
|
|
}
|
|
}
|
|
std::string MolDraw2DCairo::getDrawingText() const {
|
|
PRECONDITION(dp_cr, "no draw context");
|
|
std::string res = "";
|
|
cairo_surface_t *surf = cairo_get_target(dp_cr);
|
|
cairo_surface_write_to_png_stream(surf, &grab_str, (void *)&res);
|
|
return res;
|
|
};
|
|
|
|
void MolDraw2DCairo::writeDrawingText(const std::string &fName) const {
|
|
PRECONDITION(dp_cr, "no draw context");
|
|
cairo_surface_t *surf = cairo_get_target(dp_cr);
|
|
cairo_surface_write_to_png(surf, fName.c_str());
|
|
};
|
|
|
|
} // EO namespace RDKit
|