Code

WIP: Refactor of subsampling module#98

Code

Open

dotsdl wants to merge 9 commits intomasteralchemistry/alchemlyb:masterfrom refactor-subsamplingalchemistry/alchemlyb:refactor-subsamplingCopy head branch name to clipboard

+883-163

Commits

Commits on Jan 29, 2020

• Refactor of subsampling module

  Show description for 6acd40c
  dotsdl

  committed
  6acd40c

  Copy full SHA for 6acd40c

Commits on Feb 6, 2020

• Added tests for subsampling on most of our datasets

  Show description for 166cace
  dotsdl

  committed
  166cace

  Copy full SHA for 166cace

• Docs for subsamplers reflect a change in direction

  Show description for 0043af9
  dotsdl

  committed
  0043af9

  Copy full SHA for 0043af9

Commits on Feb 11, 2020

• statistical_inefficiency should now behave according to its doc

  Show description for ec591ef
  dotsdl

  committed
  ec591ef

  Copy full SHA for ec591ef

• Tests passing for statistical_inefficiency

  Show description for 2a1d27f
  dotsdl

  committed
  2a1d27f

  Copy full SHA for 2a1d27f

Commits on Feb 13, 2020

• equilibrium_detection now shares same basic code as statistical_inefficiency

  Show description for 1b387cc
  dotsdl

  committed
  1b387cc

  Copy full SHA for 1b387cc

Commits on Feb 18, 2020

• alchemform hits a stumbling block

  Show description for 523cdd3
  dotsdl

  committed
  523cdd3

  Copy full SHA for 523cdd3

Commits on Mar 11, 2020

• Removed use of alchemform; users must explicitly choose their how

  Show description for 166f3df
  dotsdl

  committed
  166f3df

  Copy full SHA for 166f3df

• Added some test coverage for return_calculated, using a Series

  Show description for dc1b3ff
  dotsdl

  committed
  dc1b3ff

  Copy full SHA for dc1b3ff