Gromacs
2025-dev-20240913-b871546
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Classes | |
class | Rdf |
Implements gmx rdf trajectory analysis module. More... | |
class | RdfModuleData |
Temporary memory for use within a single-frame calculation. More... | |
Enumerations | |
enum | Normalization : int { Rdf, NumberDensity, None, Count } |
Normalization for the computed distribution. | |
enum | SurfaceType : int { None, Molecule, Residue, Count } |
Whether to compute RDF wrt. surface of the reference group. | |
Variables | |
const EnumerationArray < Normalization, const char * > | c_normalizationNames |
String values corresponding to Normalization. More... | |
const EnumerationArray < SurfaceType, const char * > | c_surfaceTypeNames = { { "no", "mol", "res" } } |
String values corresponding to SurfaceType. | |