ParM
parm
A molecular dynamics library
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#include <interaction.hpp>
Public Member Functions | |
EpsSigAtom () | |
EpsSigAtom (AtomID a, flt epsilon, flt sigma) | |
EpsSigAtom (AtomID a, EpsSigAtom other) | |
flt | max_size () |
Public Member Functions inherited from AtomID | |
AtomID () | |
Constructor not recommended: uses UINT_MAX for number, i.e. unknown. More... | |
AtomID (Atom *a, uint n) | |
Recommended constructor. More... | |
uint | n () const |
Public Member Functions inherited from AtomRef | |
AtomRef () | |
AtomRef (Atom *a) | |
Atom & | operator* () const |
Atom * | operator-> () const |
bool | operator== (const AtomRef &other) const |
bool | operator== (const Atom *other) const |
bool | operator!= (const AtomRef &other) const |
bool | operator< (const AtomRef &other) const |
bool | operator<= (const AtomRef &other) const |
bool | operator>= (const AtomRef &other) const |
bool | operator> (const AtomRef &other) const |
bool | is_null () |
Public Attributes | |
flt | epsilon |
flt | sigma |
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inline |
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inline |
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inline |
flt EpsSigAtom::epsilon |
flt EpsSigAtom::sigma |