Classes | |
| class | constraint_array |
| class | geometrical_hydrogens |
| Base class for all geometrically constrained hydrogen's -XHn. More... | |
| class | staggered_terminal_tetrahedral_XHn |
| Model of Z-Y-XHn with tetrahedral angles. More... | |
| class | terminal_tetrahedral_XHn |
| Model of Y-XHn with tetrahedral angles. More... | |
| class | secondary_CH2 |
| Model of X-CH2-Y. More... | |
| class | tertiary_CH |
| Model of tertiary CH. More... | |
| class | aromatic_CH_or_amide_NH |
| Model of aromatic C-H or amide N-H. More... | |
| class | terminal_trihedral_XH2 |
| Model of terminal Z-Y=XH2 (ethylenic CH2 or amide NH2). More... | |
| class | acetylenic_CH |
| Model of acetylenic X-CH. More... | |
| class | polyhedral_BH |
| Model of BH as part of a polyhedral fragment (Boron cages e.g.). More... | |
| class | many_scatterer_constraints |
| A set of constraints on some parameters of several scatterers. More... | |
| class | few_scatterer_constraints |
| Constraints on some parameters of a few scatterers. More... | |
| class | special_positions |
1.5.6