Bound

Bound

Table 6.7. Bound type members

MemberTypeAccessDescription
elementselementroArray of element data (masses, symbols, names, etc.)
datadoubleroParameters describing the bound interaction
escaledoubleroElectrostatic 1-4 scaling factor (for torsion interactions)
formstringroFunctional form of the bound interaction
idint[]roArray of atom IDs involved in the interaction
termidintroArray index of forcefield term in relevant list (ffangles, ffbonds, or fftorsions) in local pattern
typenamesstring[]roArray of typenames involved in the interaction
vscaledoubleroShort-range 1-4 scaling factor (for torsion interactions)