Gromacs
2018.8
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Classes | |
class | IndexFileWriterModule |
Data module for writing index files. More... | |
Enumerations | |
enum | ResidueNumbering { ResidueNumbering_ByNumber, ResidueNumbering_ByIndex } |
How to identify residues in output files. | |
enum | PdbAtomsSelection { PdbAtomsSelection_All, PdbAtomsSelection_MaxSelection, PdbAtomsSelection_Selected } |
Which atoms to write out to PDB files. | |
Variables | |
const char *const | cResNumberEnum [] = { "number", "index" } |
String values corresponding to ResidueNumbering. | |
const char *const | cPDBAtomsEnum [] = { "all", "maxsel", "selected" } |
String values corresponding to PdbAtomsSelection. | |