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When two lines have the same "title" AND "year" AND "authors" keep only one (the first? the most complete?)
Below the three key in ISI and SCOPUS:
- title --> ISI = TI / Scopus = Title
- year -->…
tommv updated
3 years ago
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Hi guys,
Just saw this paper from Pande et al and I thought I would share it with you guys: http://biorxiv.org/content/early/2017/04/04/123752
Still haven't read it thoroughly, but it looks prom…
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From @vtlim in my group; we should add an acknowledgment/contributions spot for her when we fix these:
- [x] p.5, left column, bottom, "The rate coefficient kab..." is not a complete sentence. I th…
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Describe precisely the difference between returned frames by fit():
`run_info, trajectory, averages = nn.fit()`
Maybe making averages and trajectory optional?
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This is work that will be used in resubmitting the 'Task-Parallel Analysis of Molecular Dynamics Trajectories' paper.
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**Submitting author:** @vyasr (Vyas Ramasubramani)
**Repository:** https://bitbucket.org/glotzer/rowan
**Version:** v1.0.0
**Editor:** @labarba
**Reviewers:** @pdebuyl, @CorySimon
**Author instructi…
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**Submitting author:** @avimanyu786 (Avimanyu Bandyopadhyay)
**Repository:** https://github.com/avimanyu786/TrajectoryMergeAssist/
**Version:** v1.1.03
**Editor:** Pending
**Reviewer:** Pending
**Aut…
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I've produced a preliminary conda build for OS X:
Try this in a clean environment (that doesn't already have any kind of access to MDAnalysis):
```
conda config --add channels treddy
conda config --…
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Hello,
I am very interested in using htmd to run some adaptive sampling simulations.
However, the examples I have seen on adaptive sampling seem to deal only with ACEMD on a local GPU cluster.
I wo…
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`pip search datreant` returns no result.