| 1 | /*
|
|---|
| 2 | * Project: MoleCuilder
|
|---|
| 3 | * Description: creates and alters molecular systems
|
|---|
| 4 | * Copyright (C) 2014 Frederik Heber. All rights reserved.
|
|---|
| 5 | *
|
|---|
| 6 | *
|
|---|
| 7 | * This file is part of MoleCuilder.
|
|---|
| 8 | *
|
|---|
| 9 | * MoleCuilder is free software: you can redistribute it and/or modify
|
|---|
| 10 | * it under the terms of the GNU General Public License as published by
|
|---|
| 11 | * the Free Software Foundation, either version 2 of the License, or
|
|---|
| 12 | * (at your option) any later version.
|
|---|
| 13 | *
|
|---|
| 14 | * MoleCuilder is distributed in the hope that it will be useful,
|
|---|
| 15 | * but WITHOUT ANY WARRANTY; without even the implied warranty of
|
|---|
| 16 | * MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the
|
|---|
| 17 | * GNU General Public License for more details.
|
|---|
| 18 | *
|
|---|
| 19 | * You should have received a copy of the GNU General Public License
|
|---|
| 20 | * along with MoleCuilder. If not, see <http://www.gnu.org/licenses/>.
|
|---|
| 21 | */
|
|---|
| 22 |
|
|---|
| 23 | /*
|
|---|
| 24 | * SphericalPointDistribution.cpp
|
|---|
| 25 | *
|
|---|
| 26 | * Created on: May 30, 2014
|
|---|
| 27 | * Author: heber
|
|---|
| 28 | */
|
|---|
| 29 |
|
|---|
| 30 | // include config.h
|
|---|
| 31 | #ifdef HAVE_CONFIG_H
|
|---|
| 32 | #include <config.h>
|
|---|
| 33 | #endif
|
|---|
| 34 |
|
|---|
| 35 | #include "CodePatterns/MemDebug.hpp"
|
|---|
| 36 |
|
|---|
| 37 | #include "SphericalPointDistribution.hpp"
|
|---|
| 38 |
|
|---|
| 39 | #include "CodePatterns/Assert.hpp"
|
|---|
| 40 | #include "CodePatterns/Log.hpp"
|
|---|
| 41 |
|
|---|
| 42 | #include <algorithm>
|
|---|
| 43 | #include <vector>
|
|---|
| 44 |
|
|---|
| 45 | #include "LinearAlgebra/Line.hpp"
|
|---|
| 46 | #include "LinearAlgebra/RealSpaceMatrix.hpp"
|
|---|
| 47 | #include "LinearAlgebra/Vector.hpp"
|
|---|
| 48 |
|
|---|
| 49 | void SphericalPointDistribution::initSelf(const int _NumberOfPoints)
|
|---|
| 50 | {
|
|---|
| 51 | switch (_NumberOfPoints)
|
|---|
| 52 | {
|
|---|
| 53 | case 0:
|
|---|
| 54 | points = get<0>();
|
|---|
| 55 | break;
|
|---|
| 56 | case 1:
|
|---|
| 57 | points = get<1>();
|
|---|
| 58 | break;
|
|---|
| 59 | case 2:
|
|---|
| 60 | points = get<2>();
|
|---|
| 61 | break;
|
|---|
| 62 | case 3:
|
|---|
| 63 | points = get<3>();
|
|---|
| 64 | break;
|
|---|
| 65 | case 4:
|
|---|
| 66 | points = get<4>();
|
|---|
| 67 | break;
|
|---|
| 68 | case 5:
|
|---|
| 69 | points = get<5>();
|
|---|
| 70 | break;
|
|---|
| 71 | case 6:
|
|---|
| 72 | points = get<6>();
|
|---|
| 73 | break;
|
|---|
| 74 | case 7:
|
|---|
| 75 | points = get<7>();
|
|---|
| 76 | break;
|
|---|
| 77 | case 8:
|
|---|
| 78 | points = get<8>();
|
|---|
| 79 | break;
|
|---|
| 80 | case 9:
|
|---|
| 81 | points = get<9>();
|
|---|
| 82 | break;
|
|---|
| 83 | case 10:
|
|---|
| 84 | points = get<10>();
|
|---|
| 85 | break;
|
|---|
| 86 | case 11:
|
|---|
| 87 | points = get<11>();
|
|---|
| 88 | break;
|
|---|
| 89 | case 12:
|
|---|
| 90 | points = get<12>();
|
|---|
| 91 | break;
|
|---|
| 92 | case 14:
|
|---|
| 93 | points = get<14>();
|
|---|
| 94 | break;
|
|---|
| 95 | default:
|
|---|
| 96 | ASSERT(0, "SphericalPointDistribution::initSelf() - cannot deal with the case "
|
|---|
| 97 | +toString(_NumberOfPoints)+".");
|
|---|
| 98 | }
|
|---|
| 99 | LOG(3, "DEBUG: Ideal polygon is " << points);
|
|---|
| 100 | }
|
|---|
| 101 |
|
|---|