sef43 openmm-mdanalysis-reporter issues - Githubissues

sef43 / openmm-mdanalysis-reporter

MIT License

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Fix error in velocity reporting for nc and ncdf file types.

#11 orionarcher closed 3 months ago
0
New PyPI release?

#10 orionarcher opened 4 months ago
1
Add writer_kwargs to MDAReporter and speed up testing

#9 orionarcher closed 5 months ago
4
Format package with black.

#8 orionarcher closed 5 months ago
0
Add a writer_kwargs argument to MDAReporter and speed up testing

#7 orionarcher closed 5 months ago
6
MDAReporter, when reporting H5MD, has no way to leave the forces or velocities out

#6 orionarcher closed 5 months ago
0
MDAReporter cannot report to H5MD

#5 orionarcher opened 6 months ago
2
`describeNextReport` states there will be no velocities, not alway true?

#4 orionarcher closed 5 months ago
7
Switch to versioningit

#3 IAlibay closed 8 months ago
2
Switch to cookiecutter template

#2 sef43 closed 1 year ago
0
remove needless "is" from selection string

#1 richardjgowers closed 1 year ago
1