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[WIP] Simple MM-GBSA implementation#22

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jchodera wants to merge 2 commits intomasterinspiremd/kinomodel:masterfrom mmpbsainspiremd/kinomodel:mmpbsaCopy head branch name to clipboard

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Commits

Commits on Feb 14, 2019

• Initial draft (untested) of MM-PBSA

  jchodera

  committed
  973c1ac

Commits on Mar 26, 2019

• Draft working version of the code

  dww100

  committed
  1767ddc