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dimchris
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mdanalysis
Automatically exported from code.google.com/p/mdanalysis
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dihedral function 0.7.2
#73
GoogleCodeExporter
closed
9 years ago
3
no module named _dcdmodule
#72
GoogleCodeExporter
closed
9 years ago
2
Trouble with installation: errors from readdcd.h
#71
GoogleCodeExporter
closed
9 years ago
3
instant selection fail/select wrong atom for residues that are also termini
#70
GoogleCodeExporter
closed
9 years ago
1
CRD.py mixes tabs and spaces
#69
GoogleCodeExporter
closed
9 years ago
2
licence and copyright header comments in sources
#68
GoogleCodeExporter
closed
9 years ago
2
LAMMPS DCD dt wrong
#67
GoogleCodeExporter
closed
9 years ago
1
distribute generated C files
#66
GoogleCodeExporter
closed
9 years ago
1
installation error -- dcdtimeseries.c missing
#65
GoogleCodeExporter
closed
9 years ago
3
universe.trajectory.delta values are rounded when read from the dcd header file
#64
GoogleCodeExporter
closed
9 years ago
5
Support for PDBs with 4 character resnames and segID output when writing (PrimitivePDBWriter)
#63
GoogleCodeExporter
closed
9 years ago
2
Large xtc files cause Segmentation Fault
#62
GoogleCodeExporter
closed
9 years ago
8
triclinic boxes in GRO and XTC/TRR have wrong angles
#61
GoogleCodeExporter
closed
9 years ago
1
PrimitivePDBReader supplies wrong CRYST1 unitcell dimensions
#60
GoogleCodeExporter
closed
9 years ago
1
Writing XTC to DCD broken
#59
GoogleCodeExporter
closed
9 years ago
12
Error in rms_fit_trj
#58
GoogleCodeExporter
closed
9 years ago
1
fixed-format writers do not check for overflow of coordinates, occupancy etc
#57
GoogleCodeExporter
closed
9 years ago
7
update documentation to reflect 0.7.x+ changes
#56
GoogleCodeExporter
closed
9 years ago
2
use the VMD mofile plugin
#55
GoogleCodeExporter
opened
9 years ago
6
pqr reader
#54
GoogleCodeExporter
closed
9 years ago
2
chained reader raises TypeError when accessing u.trajectory.dt
#53
GoogleCodeExporter
closed
9 years ago
2
Write xtc trajectories
#52
GoogleCodeExporter
closed
9 years ago
3
distance array float32/float64 type causes undetected error
#51
GoogleCodeExporter
closed
9 years ago
2
DCD Writer broken
#50
GoogleCodeExporter
closed
9 years ago
1
frame Writers' write() method does not accept a Timestep
#49
GoogleCodeExporter
closed
9 years ago
7
Sparse contact_matrix method slow
#48
GoogleCodeExporter
closed
9 years ago
18
generated ResidueGroups return either a Residue or a ResidueGroup
#47
GoogleCodeExporter
closed
9 years ago
1
write from ResidueGroup or Segment fails
#46
GoogleCodeExporter
closed
9 years ago
1
Excessive memory used when running UnitTests (e.g. fails when reaching "checking for fixed issue 34")
#45
GoogleCodeExporter
closed
9 years ago
7
Biopython 1.55 causes unit test problems
#44
GoogleCodeExporter
closed
9 years ago
2
do not require white space around parentheses in selections
#43
GoogleCodeExporter
closed
9 years ago
7
AtomSelect using pre-existing AtomGroup properties
#42
GoogleCodeExporter
closed
9 years ago
7
MDAnalysis does not import: 'with' statement not recognized in python 2.5
#41
GoogleCodeExporter
closed
9 years ago
2
CRD reader required
#40
GoogleCodeExporter
closed
9 years ago
5
reading multiple trajectory files
#39
GoogleCodeExporter
closed
9 years ago
3
XTCWriter broken
#38
GoogleCodeExporter
closed
9 years ago
1
GROWriter does not handle triclinic boxes
#37
GoogleCodeExporter
closed
9 years ago
2
AtomGroups should allow the numpy advanced slicing
#36
GoogleCodeExporter
closed
9 years ago
1
XYZ reader
#35
GoogleCodeExporter
closed
9 years ago
2
unitcell dimensions wrong for xtc/trr
#34
GoogleCodeExporter
closed
9 years ago
3
sel.principleAxes() is not correct
#33
GoogleCodeExporter
closed
9 years ago
4
segmentation fault in DCDReader.__del__
#32
GoogleCodeExporter
closed
9 years ago
3
GRO file I/O
#31
GoogleCodeExporter
closed
9 years ago
2
contact_matrix()
#30
GoogleCodeExporter
closed
9 years ago
3
PDB reader should set the box size
#29
GoogleCodeExporter
closed
9 years ago
2
put data required for testing into separate package
#28
GoogleCodeExporter
closed
9 years ago
2
DCDReader.dcd_header() and DCDReader._dcd_header() broken
#27
GoogleCodeExporter
closed
9 years ago
5
restructured text documentation
#26
GoogleCodeExporter
closed
9 years ago
8
Trajectory API
#25
GoogleCodeExporter
closed
9 years ago
4
restructure repository code layout
#24
GoogleCodeExporter
closed
9 years ago
1
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