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v1.1.0
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@Ladme Ladme released this 14 Oct 10:56
· 26 commits to main since this release
v1.1.0
c5dd4f6
  • Updated to groan_rs v0.4.1 which allows the use of regular expressions when selecting reference atoms.
  • Starting and ending time of the centering can be now specified using the -b and -e flags.
  • Multiple frame stepping is now more efficient.
  • Multiple input trajectories can be provided and these will be joined into one output file.
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