Code

Add new option for packing.solvate#1144

Code

Merged

daico007 merged 4 commits intomosdef-hub:mainmosdef-hub/mbuild:mainfrom daico007:add_center_solute_optiondaico007/mbuild:add_center_solute_optionCopy head branch name to clipboardSep 26, 2023

+25-5

Commits

Commits on Aug 30, 2023

• add center_solute option for solvate method

  daico007

  committed
  94568cf

Commits on Sep 1, 2023

• extend tests to cover center_solute option

  daico007

  committed
  35345e0

Commits on Sep 26, 2023

• Update mbuild/packing.py

  Show description for 76ce8f2
  

  daico007

  and

  CalCraven

  authored
  76ce8f2

• Merge branch 'main' into add_center_solute_option

  daico007

  authored
  d4b4259