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SSAGES
0.1
A MetaDynamics Package
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| ▼NJson | |
| CAllOfRequirement | Requires that all of a list of Requirements hold |
| CAnyOfRequirement | Requires that at least one of a list of Requirements hold |
| CArrayRequirement | Array of Requirements |
| CBooleanRequirement | Requires json value to be of type Bool |
| CDependencyRequirement | Requires dependencies to be met |
| CEnumRequirement | Requires entry to be member of an enum |
| CIntegerRequirement | Requirements on Integer values |
| CNotRequirement | Requires a given Requirement to fail |
| CNullRequirement | Requires value to be of type Null |
| CNumberRequirement | Requirements on a numeric value |
| CObjectRequirement | Requirements on an object |
| COneOfRequirement | Requires exactly one of a list of Requirements to hold |
| CRequirement | Requirements on input files |
| CRequirementLoader | Helper class to load Requirement |
| CStringRequirement | Requirements on strings |
| ▼NSSAGES | |
| CABF | Adaptive Biasing Force Algorithm |
| CAlphaRMSDCV | Collective variable to measure alpha helix secondary structure |
| CAngleCV | Collective variable to calculate angle |
| CAntiBetaRMSDCV | Collective variable to measure antiparallel beta secondary structure |
| CBasis | Basis Function Sampling Algorithm |
| CBasisLUT | Look-up table for basis functions |
| CBoxVolumeCV | Collective variable on the volume of a box |
| CBuildException | Exception to be thrown when building the Driver fails |
| CCollectiveVariable | Abstract class for a collective variable |
| CConstraint | Interface for Constraint implementations |
| CCOPSS | Wrapper class for COPSS simulations |
| CCOPSSImage | Image method |
| CCVManager | Collective variable manager |
| CDirectForwardFlux | ForwardFlux sampling method |
| CElasticBand | Multi-walker Elastic Band |
| CEventListener | Base abstract class for listening in to events fired by "Hook" |
| CFiniteTempString | Finite Temperature Spring Method |
| ▼CForwardFlux | ForwardFlux sampling method |
| CFFSConfigID | Nested class to store different FFS Config IDs |
| CGaussianPK | Gaussian Function |
| ▼CGrid | Basic Grid |
| CGridIterator | Custom Iterator |
| CGridBase | Base class for Grids |
| CGyrationTensorCV | Collective variable on components of the gyration tensor |
| CHill | Multidimensional hill |
| ▼CHistogram | Basic Histogram |
| CHistIterator | Custom Iterator |
| CHook | Base class for hooks into the simultion engines |
| CIncludePlugin | Class for JSON loader include plugin |
| CJSONLoader | Class for loading JSON content from files |
| CJSONLoaderPlugin | Abstract class for JSON loader plugins |
| CLogger | Base class for logging SSAGES data |
| CMap | Map for histogram and coefficients |
| CMeta | "Vanilla" multi-dimensional Metadynamics |
| CMethod | Interface for Method implementations |
| CMockCV | Mock collective variable for testing purposes |
| CPairwiseCV | Generalized collective variable based on pairwise properties of atoms |
| CPairwiseKernel | Pairwise kernel base class |
| CParallelBetaRMSDCV | Collective variable to measure parallel beta sheet secondary structure |
| CParticleCoordinateCV | Collective variable on a particle coordinate |
| CParticlePositionCV | Collective variable on an particle position |
| CParticleSeparationCV | Collective variable on the distance between two particles' centers of mass |
| CRationalSwitchPK | Rational Switching Function |
| CReadBackbone | Utility class to read protein backbone atoms from a reference file |
| CReadFile | Utility class to read file |
| CResourceHandler | Class that handles SSAGES resources for a simulation |
| CRMSDCV | Collective variable to calculate root mean square displacement |
| CRouseModeCV | Collective variable is a Rouse mode for a polymer chain comprised of N particle groups |
| CSnapshot | Class containing a snapshot of the current simulation in time |
| CStringMethod | String base class for FTS, Swarm, and elastic band |
| CSwarm | Swarm of Trajectories String Method |
| CTorsionalCV | Collective variable on the torsion angles |
| CUmbrella | Umbrella sampling method |
| CSerializable |
1.8.7