Oliver Beckstein
Oliver Beckstein
What is the "prospector tool"? Can you elaborate? Explain what you want to do, include links as relevant.
@aditi2906 will you be able to complete the PR? There's not much else to do as far as I can tell.
See #3744 for a discussion on how to represent the typical output data in the `Results` dict.
Welcome to contributing to MDAnalysis! Thanks for the PR. Sorry, I don't have time to review, I just wanted to ask if this PR is going to fix #3659 ?...
When I read the email I also thought of BlobGroup. In principle the new topology system allows this at the AtomGroup level: create a new attribute (blobid) and assign the...
... and ja, die `ÜberGruppe` zounds wery nice.
I don't mind claiming "Uber" – it's been used in American English before the ride sharing company. I would probably still choose a more boring and descriptive name but I...
It might be useful to work out an API proposal (sort of an "MDAnalysis Extra Enhancement Proposal" or *MEEP* for short...) that gives an idea of what the API would...
@Shlokatadistance , you might want to look deeper in how MDAnalysis represents systems, namely as numpy arrays of integers, where the integer is the id of the particle. The [2016...
Hello @danonymous856 , welcome to MDAnalysis. I suggest you introduce yourself first on the developer mailing list and let us know what you‘re interested in (GSoC or Outreachy or generally...