Package schrodinger :: Package trajectory :: Module ffstructure :: Class _FFVirtual
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Class _FFVirtual

object --+
         |
        _FFVirtual

A class to hold force field parameters for a virtual site.

Instance Methods [hide private]
 
__init__(self, ffhandle, index)
x.__init__(...) initializes x; see help(type(x)) for signature
 
_getIndex(self)
 
_setIndex(self, value)
 
_getFunct(self)
 
_setFunct(self, value)
 
_getAi(self)
 
_setAi(self, value)
 
_getAj(self)
 
_setAj(self, value)
 
_getAk(self)
 
_setAk(self, value)
 
_getAl(self)
 
_setAl(self, value)
 
_getAm(self)
 
_setAm(self, value)
 
_getAn(self)
 
_setAn(self, value)
 
_getC1(self)
 
_setC1(self, value)
 
_getC2(self)
 
_setC2(self, value)
 
_getC3(self)
 
_setC3(self, value)
 
_getC4(self)
 
_setC4(self, value)
 
_getC5(self)
 
_setC5(self, value)
 
_getC6(self)
 
_setC6(self, value)
 
_getProperty(self)
 
_setProperty(self, d)

Inherited from object: __delattr__, __format__, __getattribute__, __hash__, __new__, __reduce__, __reduce_ex__, __repr__, __setattr__, __sizeof__, __str__, __subclasshook__

Properties [hide private]
  index
Record number in ffio_sites plock of the corresponding PSEUDO particle or atom.
  funct
function name
  ai
Record numbers in the FFIO_SITES bloc of the real atom making up the pseudo particle.
  aj
aj
  ak
ak
  al
al
  am
am
  an
an
  c1
c1
  c2
c2
  c3
c3
  c4
c4
  c5
c5
  c6
c6
  property
properties

Inherited from object: __class__

Method Details [hide private]

__init__(self, ffhandle, index)
(Constructor)

 

x.__init__(...) initializes x; see help(type(x)) for signature

Overrides: object.__init__
(inherited documentation)

Property Details [hide private]

index

Record number in ffio_sites plock of the corresponding PSEUDO particle or atom. The ffio_sites record must have s_ttio_type property of pseudo

Get Method:
_getIndex(self)
Set Method:
_setIndex(self, value)

funct

function name

Get Method:
_getFunct(self)
Set Method:
_setFunct(self, value)

ai

Record numbers in the FFIO_SITES bloc of the real atom making up the pseudo particle. The FFIO_SITES record must have the s_ffio_type property of ATOM.

Get Method:
_getAi(self)
Set Method:
_setAi(self, value)

aj

aj

Get Method:
_getAj(self)
Set Method:
_setAj(self, value)

ak

ak

Get Method:
_getAk(self)
Set Method:
_setAk(self, value)

al

al

Get Method:
_getAl(self)
Set Method:
_setAl(self, value)

am

am

Get Method:
_getAm(self)
Set Method:
_setAm(self, value)

an

an

Get Method:
_getAn(self)
Set Method:
_setAn(self, value)

c1

c1

Get Method:
_getC1(self)
Set Method:
_setC1(self, value)

c2

c2

Get Method:
_getC2(self)
Set Method:
_setC2(self, value)

c3

c3

Get Method:
_getC3(self)
Set Method:
_setC3(self, value)

c4

c4

Get Method:
_getC4(self)
Set Method:
_setC4(self, value)

c5

c5

Get Method:
_getC5(self)
Set Method:
_setC5(self, value)

c6

c6

Get Method:
_getC6(self)
Set Method:
_setC6(self, value)

property

properties

Get Method:
_getProperty(self)
Set Method:
_setProperty(self, d)