source: src/Shapes/ShapeOps.cpp@ 7672551

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Last change on this file since 7672551 was 5a8d61, checked in by Frederik Heber <heber@…>, 13 years ago

Added new function to all Shape: getHomogeneousPointsInVolume().

  • basically it is not implemented except for ShapeOps, yet.
  • there is an initial unit test Shape_HomogeneousPointsUnitTest.
  • Property mode set to 100644
File size: 10.1 KB
Line 
1/*
2 * Project: MoleCuilder
3 * Description: creates and alters molecular systems
4 * Copyright (C) 2010-2012 University of Bonn. All rights reserved.
5 * Please see the LICENSE file or "Copyright notice" in builder.cpp for details.
6 */
7
8/*
9 * ShapeOps.cpp
10 *
11 * Created on: Jun 18, 2010
12 * Author: crueger
13 */
14
15// include config.h
16#ifdef HAVE_CONFIG_H
17#include <config.h>
18#endif
19
20#include "CodePatterns/MemDebug.hpp"
21
22#include <algorithm>
23#include <boost/bind.hpp>
24
25#include "Shapes/ShapeExceptions.hpp"
26#include "Shapes/ShapeOps.hpp"
27#include "Shapes/ShapeOps_impl.hpp"
28
29#include "LinearAlgebra/Vector.hpp"
30#include "CodePatterns/Assert.hpp"
31
32/*************** Base case ***********************/
33
34ShapeOpsBase_impl::ShapeOpsBase_impl(const Shape::impl_ptr &_arg) :
35 arg(_arg){}
36
37ShapeOpsBase_impl::~ShapeOpsBase_impl(){}
38
39bool ShapeOpsBase_impl::isInside(const Vector &point) const{
40 return arg->isInside(translateIn(point));
41}
42
43bool ShapeOpsBase_impl::isOnSurface(const Vector &point) const{
44 return arg->isOnSurface(translateIn(point));
45}
46
47Vector ShapeOpsBase_impl::getNormal(const Vector &point) const throw (NotOnSurfaceException){
48 Vector helper = translateIn(point);
49 if(!arg->isOnSurface(helper)){
50 throw NotOnSurfaceException() << ShapeVector(&helper);
51 }
52 Vector res = translateOutNormal(arg->getNormal(helper));
53 res.Normalize();
54 return res;
55}
56
57Vector ShapeOpsBase_impl::getCenter() const
58{
59 return arg->getCenter();
60}
61
62double ShapeOpsBase_impl::getRadius() const
63{
64 return translateOutPos(Vector(arg->getRadius(), 0., 0.)).Norm();
65}
66
67
68LineSegmentSet ShapeOpsBase_impl::getLineIntersections(const Line &line) const{
69 Line newLine(translateIn(line.getOrigin()),translateIn(line.getDirection()));
70 LineSegmentSet res(line);
71 LineSegmentSet helper = getArg()->getLineIntersections(newLine);
72 for(LineSegmentSet::iterator iter = helper.begin();iter!=helper.end();++iter){
73 LinePoint lpBegin = iter->getBegin();
74 LinePoint lpEnd = iter->getBegin();
75 // translate both linepoints
76 lpBegin = lpBegin.isNegInfinity()?
77 line.negEndpoint():
78 line.getLinePoint(translateOutPos(lpBegin.getPoint()));
79 lpEnd = lpEnd.isPosInfinity()?
80 line.posEndpoint():
81 line.getLinePoint(translateOutPos(lpEnd.getPoint()));
82 res.insert(LineSegment(lpBegin,lpEnd));
83 }
84 return res;
85}
86
87enum ShapeType ShapeOpsBase_impl::getType() const {
88 return getArg()->getType();
89}
90
91std::vector<Vector> ShapeOpsBase_impl::getHomogeneousPointsOnSurface(const size_t N) const {
92 return getArg()->getHomogeneousPointsOnSurface(N);
93}
94
95std::vector<Vector> ShapeOpsBase_impl::getHomogeneousPointsInVolume(const size_t N) const {
96 return getArg()->getHomogeneousPointsInVolume(N);
97}
98
99Shape::impl_ptr ShapeOpsBase_impl::getArg() const{
100 return arg;
101}
102
103/********************* Resize ********************/
104
105Resize_impl::Resize_impl(const Shape::impl_ptr &_arg,double _size) :
106 ShapeOpsBase_impl(_arg), size(_size)
107{
108 ASSERT(size>0,"Cannot resize a Shape to size zero or below");
109}
110
111Resize_impl::~Resize_impl(){}
112
113bool Resize_impl::isInside(const Vector& point) const{
114 return getArg()->isInside((1/size) * point);
115}
116
117Vector Resize_impl::translateIn(const Vector& point) const{
118 return (1/size) * point;
119}
120
121Vector Resize_impl::translateOutPos(const Vector& point) const{
122 return size * point;
123}
124
125Vector Resize_impl::translateOutNormal(const Vector& point) const{
126 return point;
127}
128
129std::string Resize_impl::toString() const{
130 std::stringstream sstr;
131 sstr << "resize(" << getArg()->toString() << "," << size << ")";
132 return sstr.str();
133}
134
135std::vector<Vector> Resize_impl::getHomogeneousPointsOnSurface(const size_t N) const {
136 std::vector<Vector> PointsOnSurface = getArg()->getHomogeneousPointsOnSurface(N);
137 std::for_each(PointsOnSurface.begin(), PointsOnSurface.end(),
138 boost::bind(&Vector::operator*, _1, size) );
139 return PointsOnSurface;
140}
141
142std::vector<Vector> Resize_impl::getHomogeneousPointsInVolume(const size_t N) const {
143 std::vector<Vector> PointsOnSurface = getArg()->getHomogeneousPointsInVolume(N);
144 std::for_each(PointsOnSurface.begin(), PointsOnSurface.end(),
145 boost::bind(&Vector::operator*, _1, size) );
146 return std::vector<Vector>();
147}
148
149
150Shape resize(const Shape &arg,double size){
151 Shape::impl_ptr impl = Shape::impl_ptr(new Resize_impl(getShapeImpl(arg),size));
152 return Shape(impl);
153}
154
155/*************************** translate *******************/
156
157Translate_impl::Translate_impl(const Shape::impl_ptr &_arg, const Vector &_offset) :
158 ShapeOpsBase_impl(_arg),offset(_offset)
159{}
160
161Translate_impl::~Translate_impl(){}
162
163bool Translate_impl::isInside(const Vector& point) const{
164 return getArg()->isInside(point-offset);
165}
166
167Vector Translate_impl::getCenter() const
168{
169 return getArg()->getCenter()+offset;
170}
171
172double Translate_impl::getRadius() const
173{
174 return getArg()->getRadius();
175}
176
177
178Vector Translate_impl::translateIn(const Vector& point) const{
179 return point-offset;
180}
181
182Vector Translate_impl::translateOutPos(const Vector& point) const{
183 return point+offset;
184}
185
186Vector Translate_impl::translateOutNormal(const Vector& point) const{
187 return point;
188}
189
190std::string Translate_impl::toString() const{
191 std::stringstream sstr;
192 sstr << "translate(" << getArg()->toString() << "," << offset << ")";
193 return sstr.str();
194}
195
196std::vector<Vector> Translate_impl::getHomogeneousPointsOnSurface(const size_t N) const {
197 std::vector<Vector> PointsOnSurface = getArg()->getHomogeneousPointsOnSurface(N);
198 std::for_each(PointsOnSurface.begin(), PointsOnSurface.end(),
199 boost::bind(&Vector::operator+, _1, offset) );
200 return PointsOnSurface;
201}
202
203std::vector<Vector> Translate_impl::getHomogeneousPointsInVolume(const size_t N) const {
204 std::vector<Vector> PointsOnSurface = getArg()->getHomogeneousPointsInVolume(N);
205 std::for_each(PointsOnSurface.begin(), PointsOnSurface.end(),
206 boost::bind(&Vector::operator+, _1, offset) );
207 return PointsOnSurface;
208}
209
210Shape translate(const Shape &arg, const Vector &offset){
211 Shape::impl_ptr impl = Shape::impl_ptr(new Translate_impl(getShapeImpl(arg),offset));
212 return Shape(impl);
213}
214
215/*********************** stretch ******************/
216
217Stretch_impl::Stretch_impl(const Shape::impl_ptr &_arg, const Vector &_factors) :
218 ShapeOpsBase_impl(_arg),factors(_factors)
219{
220 for(int i = NDIM;i--;){
221 ASSERT(factors[i]>0.,"cannot stretch a shape by a negative amount");
222 reciFactors[i] = 1./factors[i];
223 }
224}
225
226Stretch_impl::~Stretch_impl(){}
227
228bool Stretch_impl::isInside(const Vector& point) const{
229 Vector helper=point;
230 helper.ScaleAll(reciFactors);
231 return getArg()->isInside(helper);
232}
233
234Vector Stretch_impl::translateIn(const Vector& point) const{
235 Vector helper=point;
236 helper.ScaleAll(reciFactors);
237 return helper;
238}
239
240Vector Stretch_impl::translateOutPos(const Vector& point) const{
241 Vector helper=point;
242 helper.ScaleAll(factors);
243 return helper;
244}
245
246Vector Stretch_impl::translateOutNormal(const Vector& point) const{
247 Vector helper=point;
248 // the normalFactors are derived from appearances of the factors
249 // with in the vectorproduct
250 Vector normalFactors;
251 normalFactors[0]=factors[1]*factors[2];
252 normalFactors[1]=factors[0]*factors[2];
253 normalFactors[2]=factors[0]*factors[1];
254 helper.ScaleAll(normalFactors);
255 return helper;
256}
257
258std::string Stretch_impl::toString() const{
259 std::stringstream sstr;
260 sstr << "stretch(" << getArg()->toString() << "," << factors << ")";
261 return sstr.str();
262}
263
264std::vector<Vector> Stretch_impl::getHomogeneousPointsOnSurface(const size_t N) const {
265 std::vector<Vector> PointsOnSurface = getArg()->getHomogeneousPointsOnSurface(N);
266 std::for_each(PointsOnSurface.begin(), PointsOnSurface.end(),
267 boost::bind( static_cast<void (Vector::*)(const Vector&)>(&Vector::ScaleAll), _1, reciFactors) );
268 return PointsOnSurface;
269}
270
271std::vector<Vector> Stretch_impl::getHomogeneousPointsInVolume(const size_t N) const {
272 std::vector<Vector> PointsOnSurface = getArg()->getHomogeneousPointsInVolume(N);
273 std::for_each(PointsOnSurface.begin(), PointsOnSurface.end(),
274 boost::bind( static_cast<void (Vector::*)(const Vector&)>(&Vector::ScaleAll), _1, reciFactors) );
275 return PointsOnSurface;
276}
277
278Shape stretch(const Shape &arg, const Vector &factors){
279 Shape::impl_ptr impl = Shape::impl_ptr(new Stretch_impl(getShapeImpl(arg),factors));
280 return Shape(impl);
281}
282
283/************************* transform *****************/
284
285Transform_impl::Transform_impl(const Shape::impl_ptr &_arg, const RealSpaceMatrix &_transformation) :
286 ShapeOpsBase_impl(_arg),transformation(_transformation)
287{
288 transformationInv = transformation.invert();
289}
290
291Transform_impl::~Transform_impl(){}
292
293bool Transform_impl::isInside(const Vector& point) const{
294 return getArg()->isInside(transformationInv * point);
295}
296
297Vector Transform_impl::translateIn(const Vector& point) const{
298 return transformationInv * point;
299}
300
301Vector Transform_impl::translateOutPos(const Vector& point) const{
302 return transformation * point;
303}
304
305Vector Transform_impl::translateOutNormal(const Vector& point) const
306{
307 RealSpaceMatrix mat = transformation.invert().transpose();
308 return mat * point;
309}
310
311std::string Transform_impl::toString() const{
312 std::stringstream sstr;
313 sstr << "transform(" << getArg()->toString() << "," << transformation << ")";
314 return sstr.str();
315}
316
317std::vector<Vector> Transform_impl::getHomogeneousPointsOnSurface(const size_t N) const {
318 std::vector<Vector> PointsOnSurface = getArg()->getHomogeneousPointsOnSurface(N);
319 std::transform( PointsOnSurface.begin(), PointsOnSurface.end(), PointsOnSurface.begin(),
320 boost::bind(static_cast<Vector(*)(const RealSpaceMatrix&,const Vector&)>(operator*), transformation, _1));
321 return PointsOnSurface;
322}
323
324std::vector<Vector> Transform_impl::getHomogeneousPointsInVolume(const size_t N) const {
325 std::vector<Vector> PointsOnSurface = getArg()->getHomogeneousPointsInVolume(N);
326 std::transform( PointsOnSurface.begin(), PointsOnSurface.end(), PointsOnSurface.begin(),
327 boost::bind(static_cast<Vector(*)(const RealSpaceMatrix&,const Vector&)>(operator*), transformation, _1));
328 return PointsOnSurface;
329}
330
331Shape transform(const Shape &arg, const RealSpaceMatrix &transformation){
332 Shape::impl_ptr impl = Shape::impl_ptr(new Transform_impl(getShapeImpl(arg),transformation));
333 return Shape(impl);
334}
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