#include <solventExcludedSurface.h>
Public Member Functions | |
Constructors and Destructors | |
| SESComputer () throw () | |
| Default constructor. | |
| SESComputer (SolventExcludedSurface *ses) throw () | |
| Detailed constructor. | |
| virtual | ~SESComputer () throw () |
| Destructor. | |
Accessors | |
| void | run () throw (Exception::GeneralException) |
| Computes the solvent excluded surface. | |
Protected Attributes | |
| SolventExcludedSurface * | ses_ |
| HashGrid3< Index > | vertex_grid_ |
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Default constructor. This method creates a new SESComputer object. |
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Destructor. As there are no dynamic data structures, nothing happens. |