edu.duke.cs.osprey
3.3
edu.duke.cs.osprey
/
edu.duke.cs.osprey.gui.compiler
/
CompiledConfSpace
/
ConfInfo
Conf
Info
data
class
ConfInfo
(
id
:
String
,
type
:
String
,
atoms
:
List
<
CompiledConfSpace.AtomInfo
>
,
motions
:
List
<
CompiledConfSpace.MotionInfo
>
,
fragIndex
:
Int
,
internalEnergies
:
List
<
Double
>
)
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Properties
Properties
atoms
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val
atoms
:
List
<
CompiledConfSpace.AtomInfo
>
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fragIndex
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val
fragIndex
:
Int
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to index into the atom pairs
id
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val
id
:
String
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internalEnergies
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val
internalEnergies
:
List
<
Double
>
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in the same order as the forcefields
motions
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val
motions
:
List
<
CompiledConfSpace.MotionInfo
>
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type
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val
type
:
String
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