Forces¶
The module openmmtools.forces
implements custom forces that are not natively found in OpenMM.
Restraint Force Classes¶
Base class for radially-symmetric restraint force. |
|
Base class for radially-symmetric restraints between the centroids of two groups of atoms. |
|
Base class for radially-symmetric restraints between two atoms. |
|
A mix-in providing the interface for harmonic restraints. |
|
Impose a single harmonic restraint between the centroids of two groups of atoms. |
|
Impose a single harmonic restraint between two atoms. |
|
A mix-in providing the interface for flat-bottom restraints. |
|
A restraint between the centroids of two groups of atoms using a flat potential well with harmonic walls. |
|
A restraint between two atoms using a flat potential well with harmonic walls. |
Useful Custom Forces¶
A force modelling switched reaction-field electrostatics. |
Utility functions¶
Iterate over and restore the Python interface of the forces in the system. |
|
Find all the |
Exceptions¶
Error raised when multiple forces of the same class are found. |
|
Error raised when no forces matching the given criteria are found. |