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Packages that use FrameIndexSet | |
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jgromacs.analysis | jgromacs.analysis is a collection of classes providing static methods for various analysis tasks |
jgromacs.data | jgromacs.data is a collection of classes representing multiple levels of structural data |
Uses of FrameIndexSet in jgromacs.analysis |
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Methods in jgromacs.analysis that return FrameIndexSet | |
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static FrameIndexSet |
Similarity.findSimilarFramesDRMSD(Trajectory t,
jama.Matrix reference,
double cutoff)
Returns the list of frames in a trajectory that are more similar to a reference distance matrix (based on the dRMSD similarity measure) than a cutoff value |
static FrameIndexSet |
Similarity.findSimilarFramesDRMSD(Trajectory t,
PointList reference,
double cutoff)
Returns the list of frames in a trajectory that are more similar to a reference frame (based on the dRMSD similarity measure) than a cutoff value |
static FrameIndexSet |
Similarity.findSimilarFramesRMSD(Trajectory t,
PointList reference,
double cutoff)
Returns the set of frames in a trajectory that are more similar to a reference frame (based on the RMSD similarity measure) than a cutoff value |
static FrameIndexSet |
Distances.getFramesWhereAtomIsCloseToPoint(Trajectory t,
int atomindex,
Point3D point,
double cutoff)
Returns the list of frames in the trajectory where an atoms is closer to a reference point than a given cutoff |
static FrameIndexSet |
Distances.getFramesWhereAtomIsDistantFromPoint(Trajectory t,
int atomindex,
Point3D point,
double cutoff)
Returns the list of frames in the trajectory where an atoms is more distant from a reference point than a given cutoff |
static FrameIndexSet |
Distances.getFramesWhereAtomsAreClose(Trajectory t,
int atomindex1,
int atomindex2,
double cutoff)
Returns the list of frames in a trajectory where two atoms are closer to each other than the given cutoff |
static FrameIndexSet |
Distances.getFramesWhereAtomsAreDistant(Trajectory t,
int atomindex1,
int atomindex2,
double cutoff)
Returns the list of frames in a trajectory where two atoms are more distant from each other than the given cutoff |
Uses of FrameIndexSet in jgromacs.data |
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Methods in jgromacs.data that return FrameIndexSet | |
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FrameIndexSet |
FrameIndexSet.intersect(FrameIndexSet other)
Returns the intersection of this frame index set and another |
FrameIndexSet |
FrameIndexSet.subtract(FrameIndexSet other)
Returns the subtraction of another frame index set from this frame index set |
FrameIndexSet |
FrameIndexSet.union(FrameIndexSet other)
Returns the union of this frame index set and another |
Methods in jgromacs.data with parameters of type FrameIndexSet | |
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Trajectory |
Trajectory.getSubTrajectory(FrameIndexSet framelist)
Returns the subtrajectory defined by the given frame list |
FrameIndexSet |
FrameIndexSet.intersect(FrameIndexSet other)
Returns the intersection of this frame index set and another |
FrameIndexSet |
FrameIndexSet.subtract(FrameIndexSet other)
Returns the subtraction of another frame index set from this frame index set |
FrameIndexSet |
FrameIndexSet.union(FrameIndexSet other)
Returns the union of this frame index set and another |
Constructors in jgromacs.data with parameters of type FrameIndexSet | |
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FrameIndexSet(FrameIndexSet set)
Constructs a new FrameIndexSet object identical to a given FrameIndexSet |
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