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Releases: JuliaMolSim/NeighbourLists.jl

v0.5.0

22 Jul 18:33
v0.5.0
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v0.5.0 (2019-07-22)

Diff since v0.4.1

Closed issues:

  • TODO (#16)
  • Store shifts as well as indices (#14)
  • nbody iterators (#12)
  • Huge Bug in all maptosites! implementations (#8)
  • Virial (#5)

v0.4.1

03 Jul 08:43
v0.4.1
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v0.4.0

09 Jun 11:03
v0.4.0
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minor bugfix

19 Mar 09:13
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v0.3.1

bugfix in Pair iterator

Update to Julia 1.0

16 Feb 21:51
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This release should work on 0.7, 1.0.x and 1.1.x

Various bugfixes

16 Feb 21:53
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v0.2.2

fixed some tests

Minor Improvements and bug fixes

25 May 05:59
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  • minor bugfixes and efficiency improvements
  • generalised nbody loop to work with NBodyIPs
  • work-around for a PBC bug

Multi-Threading

22 Mar 23:16
680dec3
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a first basic mt implementation and some restructuring; breaks compatibility hence increase minor version

NeighbourLists.jl Initial Release

05 Mar 21:09
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  • CellList fully implemented and tested against matscipy
  • Preliminary JuLIP-independent Testing
  • drafts of the iterators