Code

Link cells without PBC#1100

Code

Merged

carlocamilloni merged 11 commits intomasterplumed/plumed2:masterfrom fix-link-cells-nopbcplumed/plumed2:fix-link-cells-nopbcCopy head branch name to clipboardJan 30, 2025

+3,514-12

Commits

Commits on Jul 24, 2024

• Made implementation of link cells that should work even if you don't have PBC

  

  Gareth Aneurin Tribello

  authored and

  Gareth Aneurin Tribello

  committed
  e284c70

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• Added code to test link cell stuff with nopbc

  

  Gareth Aneurin Tribello

  authored and

  Gareth Aneurin Tribello

  committed
  900a1f1

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Commits on Jan 27, 2025

• Merge branch 'master' into fix-link-cells-nopbc

  

  Gareth Aneurin Tribello

  authored and

  Gareth Aneurin Tribello

  committed
  80fa551

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• Fix of bug introduced after merge of master

  

  Gareth Aneurin Tribello

  authored and

  Gareth Aneurin Tribello

  committed
  975ccdd

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• This modification deals with cases with nopbc where link cell cutoff is not really set

  

  Gareth Aneurin Tribello

  authored and

  Gareth Aneurin Tribello

  committed
  b7af9e7

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• Added error message output for link cells to see problem in waterbridge3

  

  Gareth Aneurin Tribello

  authored and

  Gareth Aneurin Tribello

  committed
  e60f8df

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Commits on Jan 28, 2025

• Attempted fix for LinkCells

  

  Gareth Aneurin Tribello

  authored and

  Gareth Aneurin Tribello

  committed
  e8aa726

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• More detailed output in error message to determine problem on github

  

  Gareth Aneurin Tribello

  committed
  e4f7132

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• Added even more detail to output for link cells

  

  Gareth Aneurin Tribello

  committed
  1f5a215

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• More debug information for test

  

  Gareth Aneurin Tribello

  committed
  e24a3bb

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Commits on Jan 30, 2025

• Another attempt to fix problem with new link cell version

  

  Gareth Aneurin Tribello

  committed
  ad9614a

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