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djay0529
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mdanalysis
Automatically exported from code.google.com/p/mdanalysis
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Timeseries not implemented for gromacs
#186
GoogleCodeExporter
opened
9 years ago
3
heavy atom hydrogen bonding distance
#185
GoogleCodeExporter
closed
9 years ago
3
Read TPR file for CHARMM and AMBER forcefields
#184
GoogleCodeExporter
closed
9 years ago
13
online docs on readthedocs
#183
GoogleCodeExporter
closed
9 years ago
7
mathematics not typeset properly in release html docs
#182
GoogleCodeExporter
closed
9 years ago
8
RDC calculation
#181
GoogleCodeExporter
opened
9 years ago
2
Coordinate fitting and alignment docs
#180
GoogleCodeExporter
opened
9 years ago
0
More abstract base.Timestep – add set_dimensions()
#179
GoogleCodeExporter
closed
9 years ago
2
Review for feature-mol2reader
#178
GoogleCodeExporter
closed
9 years ago
1
Review for feature-capping branch
#177
GoogleCodeExporter
closed
9 years ago
1
asUniverse doesn't recognize instances of classes that inherit MDAnalysis.Universe
#176
GoogleCodeExporter
closed
9 years ago
2
Interchangeability of AtomGroup and selection strings
#175
GoogleCodeExporter
opened
9 years ago
2
Named groups in selection
#174
GoogleCodeExporter
closed
9 years ago
2
cannot pickle universe object
#173
GoogleCodeExporter
opened
9 years ago
13
Considering periodic images when calculating angles
#172
GoogleCodeExporter
closed
9 years ago
3
new AtomGroup.joinSelections() method instead of AtomGroup.selectAtoms(*selections)
#171
GoogleCodeExporter
closed
9 years ago
3
support for pdb anisotropy records (aka as 'altloc' in vmd-speak )
#170
GoogleCodeExporter
closed
9 years ago
6
Contact analysis improvement
#169
GoogleCodeExporter
closed
9 years ago
4
MDAnalysis install fails on broken dependency.
#168
GoogleCodeExporter
closed
9 years ago
2
download statistics gathering
#167
GoogleCodeExporter
opened
9 years ago
1
AttributeError: 'Universe' object has no attribute 'dcd'
#166
GoogleCodeExporter
closed
9 years ago
4
XDRClean problem
#165
GoogleCodeExporter
closed
9 years ago
1
Timestep copy not working
#164
GoogleCodeExporter
closed
9 years ago
7
Atomgroup Timestep is mostly empty
#163
GoogleCodeExporter
closed
9 years ago
14
TRR support does not properly account for frames without coords/vels/forces
#162
GoogleCodeExporter
closed
9 years ago
6
Trajectory slicing with ContactAnalysis1
#161
GoogleCodeExporter
closed
9 years ago
1
Code review request
#160
GoogleCodeExporter
closed
9 years ago
2
XPDB test in feature-xpbd created
#159
GoogleCodeExporter
closed
9 years ago
2
Error Producing Universes from pdbs Containing Blank Lines
#158
GoogleCodeExporter
closed
9 years ago
2
Merge two AtomGroups into a new Universe
#157
GoogleCodeExporter
closed
9 years ago
6
Periodic Boundary Treatment in AtomGroup
#156
GoogleCodeExporter
closed
9 years ago
6
alternative distribution for tarballs
#155
GoogleCodeExporter
closed
9 years ago
2
TRR/XTC writer does not include timestep or time information for frames
#154
GoogleCodeExporter
closed
9 years ago
5
Application of periodic boundary conditions
#153
GoogleCodeExporter
closed
9 years ago
4
New reader class (trz)
#152
GoogleCodeExporter
closed
9 years ago
3
distance_array giving incorrect results
#151
GoogleCodeExporter
closed
9 years ago
7
building with Windows MinGW
#150
GoogleCodeExporter
opened
9 years ago
28
apt sources to not work for debian
#149
GoogleCodeExporter
opened
9 years ago
5
enable "advanced slicing" for ResidueGroup and SegmentGroup
#148
GoogleCodeExporter
closed
9 years ago
1
mdanalysis wrong dependency
#147
GoogleCodeExporter
closed
9 years ago
2
Unicode Filename Errors
#146
GoogleCodeExporter
closed
9 years ago
2
make installation work when OpenMP is not available
#145
GoogleCodeExporter
closed
9 years ago
4
Rotation+translation - coordinates appear changed
#144
GoogleCodeExporter
closed
9 years ago
4
MDAnalysis.analysis.align.alignto fails with ZeroDivisionError when atoms don't match
#143
GoogleCodeExporter
closed
9 years ago
1
installation with Python 2.7 on Mac OS X 10.7/10.8 broken
#142
GoogleCodeExporter
closed
9 years ago
17
ImportError: No module named _dcdmodule
#141
GoogleCodeExporter
closed
9 years ago
2
No NCDF reading/writing code example on wiki
#140
GoogleCodeExporter
closed
9 years ago
2
add a LAMMPS data file parser
#139
GoogleCodeExporter
closed
9 years ago
3
Default behavior of MDAnalysis.analysis.hbonds
#138
GoogleCodeExporter
closed
9 years ago
1
KDTree.NeighborSearch.list_search with periodic boundary conditions
#137
GoogleCodeExporter
opened
9 years ago
5
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