mFES - molecular Finite Element Solver
0.4
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Wraps methods used by LSMS to build the initial fine grained molecular surface of a protein. More...
#include <fstream>
#include <sstream>
#include <math.h>
#include <vector>
#include "VCG.h"
#include "LSMS/molTypes.h"
#include "LSMS/gridTypes.h"
#include "LSMS/grid.h"
#include "LSMS/pdbLoader.h"
#include "LSMS/sceneBuilder.h"
Go to the source code of this file.
Classes | |
class | STLFacet |
class | LSMS |
A small LSMS wrapper which is directly using some methods or calling them from LSMS lib files. More... | |
Typedefs | |
typedef boost::property_tree::ptree | INI |
typedef mMesh::FaceIterator | FaceIterator |
typedef mMesh::VertexIterator | VertexIterator |
Variables | |
Molecule | mol = NULL |
float | minx |
float | miny |
float | minz |
float | maxx |
float | maxy |
float | maxz |
double | s |
Wraps methods used by LSMS to build the initial fine grained molecular surface of a protein.
This file uses LSMS developed by Tolga Can <http://www.ceng.metu.edu.tr/~tcan/LSMS/>. Some special cases like the one atom possibility, some memory leaks and some small boundary issues scaling the protein are solved.
typedef mMesh::FaceIterator FaceIterator |
typedef boost::property_tree::ptree INI |
typedef mMesh::VertexIterator VertexIterator |
float maxx |
float maxy |
float maxz |
float minx |
float miny |
float minz |
double s |