SimonEnsemble/PoreMatMod.jl

Issues

• TagBot trigger issue

  #119 opened 3 years ago by JuliaTagBot
  10

• Question: Moiety Sorted

  #151 opened a year ago by galjos
  4

• Notebook example tests fail

  #136 opened a year ago by eahenle
  0

• example notebooks run wrong version

  #141 opened a year ago by eahenle
  0

• fixup_stdlib_path not found

  #150 opened a year ago by galjos
  2

• Replacement performed at first instance of functional group

  #149 opened a year ago by jaharvey8
  1

• Failure to load data

  #135 opened 2 years ago by sensiang705
  2

• Docs build failure

  #137 opened 2 years ago by eahenle
  0

• Update CSV compat?

  #130 opened 3 years ago by longemen3000
  1

• compile executable?

  #129 opened 3 years ago by eahenle
  0

• temporary files

  #128 opened 3 years ago by eahenle
  0

• PoreMatModGO execution fallback

  #125 opened 3 years ago by eahenle
  0

• incompatibility w/ PorousMaterials 0.4.0

  #124 opened 3 years ago by eahenle
  0

• `ExampleHelpers` doing too much

  #113 opened 3 years ago by eahenle
  0

• link to paper

  #53 opened 3 years ago by eahenle
  0

• Julia 1.7.0 support

  #101 opened 3 years ago by eahenle
  0

• results depend on CPU architecture?

  #92 opened 3 years ago by eahenle
  3

• wall time limit on tests

  #109 opened 3 years ago by SimonEnsemble
  0

• `view_structure` "loses" atoms

  #107 opened 3 years ago by eahenle
  0

• slice `Search`es?

  #105 opened 3 years ago by eahenle
  0

• if there are no bonds in parent throw error?

  #103 opened 3 years ago by SimonEnsemble
  0

• separate PoreMatModGO file inputs

  #98 opened 3 years ago by eahenle
  0

• add function to launch GUI

  #96 opened 3 years ago by eahenle
  0

• codecov

  #72 opened 3 years ago by eahenle
  1

• use `@views`

  #90 opened 3 years ago by eahenle
  0

• CI build on PRs

  #87 opened 3 years ago by eahenle
  0

• migrate to GitLab CI

  #85 opened 3 years ago by eahenle
  1

• `view_crystal` fails on sliced `Crystal`

  #50 opened 3 years ago by eahenle
  1

• docs

  #67 opened 3 years ago by eahenle
  1

• v0.1.1 checklist

  #73 opened 3 years ago by eahenle
  5

• better way to highlight masked atoms?

  #74 opened 3 years ago by eahenle
  0

• optimal alignment

  #66 opened 3 years ago by eahenle
  0

• package registration

  #68 opened 3 years ago by eahenle
  0

• link to docs broken in README

  #36 opened 3 years ago by SimonEnsemble
  1

• export examples to html

  #55 opened 3 years ago by eahenle
  0

• build_replacement_data mutates query

  #56 opened 3 years ago by eahenle
  0

• publish code

  #58 opened 3 years ago by eahenle
  0

• replacement across PB glitches w/ new OP

  #59 opened 3 years ago by eahenle
  2

• change how OP is handled

  #39 opened 3 years ago by eahenle
  2

• docs

  #42 opened 3 years ago by eahenle
  0

• bogus function signature warning

  #49 opened 3 years ago by eahenle
  0

• better naming for `child`

  #54 opened 3 years ago by eahenle
  0

• create official workflow for discrete molecules as `parent`

  #52 opened 3 years ago by eahenle
  0

• sugar for replacement

  #38 opened 3 years ago by eahenle
  2

• change `exact` flag to `disconnected_component`

  #45 opened 3 years ago by eahenle
  0

• allow literal `nothing` replacement

  #40 opened 3 years ago by eahenle
  0

• add `induced` flag

  #44 opened 3 years ago by eahenle
  0

• require file ending in moiety call

  #37 opened 3 years ago by eahenle
  0

• auto-masking

  #41 opened 3 years ago by eahenle
  0

• Rename to PoreMatMod

  #34 opened 3 years ago by eahenle
  2