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Pteros
2.0
Molecular modeling library for human beings!
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▼Npteros | |
CAtom | Class which represents a single atom |
CAtomHandler | Auxilary type used to incapsulate the atom and its current coordinates Used internally in Selection::operator[] and in iterator access to Selection |
CBabelWrapper | Generic API for reading and writing any molecule file formats |
CDataContainer | Auxiliary container for sending data to tasks |
CDcdFile | Generic API for reading and writing any molecule file formats |
CDistanceSearchWithin | Class for within searching |
CFileHandler | Generic API for reading and writing any molecule file formats |
CForceField | Force field parameters of the system |
CFrame | Definition of single trajectory frame |
CFrameInfo | Information about current frame, which is passed to Consumer for analysis along with the frame itself |
CGNM | Implementation of the Gaussian Network Model (GNM) protein model |
CGrid | Sorting the atoms from given selection into the cells of 3D grid with given dimensions |
CGroFile | Reader for GRO files. It doesn't use VMD plugins because it doesn't support writing |
CHistogram | Simple histogram class |
CHistogram2D | Simple 2D histogram class |
CMol2File | Use VMD plugin for MOL2 |
COptions | All options obtained from command line including nested options for tasks |
CPdbFile | Use VMD plugin for PDB |
CPeriodicBox | Class encapsulating all operations with arbitrary triclinic periodic boxes This class stores the periodic box itself and also contains pre-computed matrices for converting laboratory coordinates to the coordinates in triclinic basis and vice versa |
CPterosError | Represents an error in the Pteros code. Used for all Pteros-related exceptions |
▼CSelection | Selection class |
Citerator | Random-access forward iterator for Selection |
CSelectionParser | Selection parser class |
CSystem | The system of atoms |
CTaskPlugin | Base class for plugins |
CTngFile | Use VMD plugin for TNG |
CTrajectoryReader | The base class for trajectory processing It provides facilities for loading large trajectories by frames and to analyze each frame by user-defined function |
CVmdMolfilePluginWrapper | Generic API for reading and writing any molecule file formats |
CXyzFile | Generic API for reading and writing any molecule file formats |