phockett/epsman

Issues

• Electronic structure file handling (Gamess, Molden)

  #15 opened 4 years ago by phockett
  5

• Zenodo large file handling

  #4 opened 5 years ago by phockett
  1

• Merging/overlap of electronic structure + job handling classes

  #16 opened 3 years ago by phockett
  4

• ePS inp/out file handling and scripts.

  #10 opened 5 years ago by phockett
  2

• Running and managing ePS remotely

  #17 opened 3 years ago by phockett
  2

• Installation notes and docs

  #14 opened 4 years ago by phockett
  1

• Logging

  #19 opened 3 years ago by phockett
  0

• General methods for get/set attribs and dictionary items

  #18 opened 3 years ago by phockett
  0

• ePS local file settings

  #9 opened 5 years ago by phockett
  2

• Job logging

  #8 opened 5 years ago by phockett
  2

• Remote env generation with Fabric for Anaconda

  #13 opened 4 years ago by phockett
  0

• Job recovery & tidy-up: checkpoint and/or logging

  #12 opened 4 years ago by phockett
  0

• Repo uploads

  #5 opened 5 years ago by phockett
  5

• web build

  #11 opened 5 years ago by phockett
  0

• Consistent job title handling

  #6 opened 5 years ago by phockett
  2

• Job packaging scheme

  #7 opened 5 years ago by phockett
  0

• Template testing

  #2 opened 5 years ago by phockett
  1

• Shell scripts with Fabric & Conda

  #3 opened 5 years ago by phockett
  1

• ePSproc notebook automation

  #1 opened 5 years ago by phockett
  2