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Suite 2012 Schrodinger Python API
Package schrodinger
::
Package application
::
Package desmond
::
Module fep_gui
:: Class _Atom
[
hide private
]
[
frames
] |
no frames
]
Class _Atom
Instance Methods
[
hide private
]
__init__
(
self
,
atom_type
,
elem
,
name
,
bonded_atom
,
q
=
0
)
Construct an _Atom.
is_matched
(
self
,
atom
,
ct
)
Method Details
[
hide private
]
__init__
(
self
,
atom_type
,
elem
,
name
,
bonded_atom
,
q
=
0
)
(Constructor)
Construct an _Atom.
Parameters:
name
- The name to be shown in the target table.
bonded_atom
- A list of tuples that contains two elements: one is an integer specifying the bond order (1, 2, 3, ...), the other is a string specifying the element of the bonded atom.
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Suite 2012 Schrodinger Python API
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