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2a1b779
fixes tests calling the SimMaker
salotz Mar 30, 2021
0844bb7
add openmm_systems to the dev env
salotz Mar 30, 2021
2d7ae86
removes `resampler_field_{dtypes,shapes}` from resamplers
salotz Mar 30, 2021
fa2082c
WIP: made initial changes
salotz Apr 7, 2021
105892c
adds preliminary support for variable number of walkers in WepyHDF5
salotz Sep 13, 2021
3060a19
removes the networkx import in wepy.hdf5
salotz Sep 14, 2021
e285ba4
improves performance of `run_cycle_walker_idxs`
salotz Sep 14, 2021
e33f083
fixes `get_traj_field` for sparse fields
salotz Sep 14, 2021
312d808
fixes the way "frames" specs are handled, fix sparse weights
salotz Sep 16, 2021
d1b3561
clarifies selection arguments for `get_traj_fields`
salotz Sep 16, 2021
60523d3
fix bug in `get_traj_field` from last commit
salotz Sep 16, 2021
05cf4c5
add/fix the progress section
salotz Oct 29, 2021
ab6f684
removes image stuff from REVO RESAMPLER_* constants
salotz Oct 29, 2021
dc65a0d
Merge pull request #1 from stxinsite/westpa-integration-fixes
salotz-sitx Nov 1, 2021
b3fef55
Merge branch 'master' of github.com:ADicksonLab/wepy
salotz-sitx Nov 1, 2021
1a9f32c
Merge pull request #3 from stxinsite/fix.gh.27
salotz-sitx Nov 1, 2021
0f375b4
Merge pull request #2 from stxinsite/fix.gh.16
salotz-sitx Nov 1, 2021
02151ac
Merge branch 'master' of github.com:stxinsite/wepy
salotz-sitx Nov 1, 2021
dc3cb86
fixes missing self in some methods
salotz-sitx Nov 30, 2021
96a8a76
fix bug in traj_fields_to_mdtraj
salotz-sitx Dec 7, 2021
68c9ccb
port fixes for just the REVO merge bug
salotz-sitx Dec 17, 2021
352d4c1
Merge pull request #5 from stxinsite/revo-merge-bug
salotz-sitx Jan 3, 2022
e0e79c9
bugfix for wexplore
salotz-sitx Mar 2, 2022
d665de0
Merge pull request #6 from stxinsite/fix-wexplore
salotz-sitx Mar 2, 2022
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3 changes: 3 additions & 0 deletions envs/dev/requirements.in
Original file line number Diff line number Diff line change
Expand Up @@ -2,6 +2,9 @@
wheel
twine

# stuff needed for running test systems
git+https://github.com/ADicksonLab/openmm_systems


# meta repo tooling

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