DX2CUBE(1)

πŸ“¦
version 3.6.1 Β· 3 versions
, in debian trixie, ubuntu noble, ubuntu questing

πŸ’– DX2CUBE β€” the manual page, but make it cute πŸ’–

okay bestie, welcome to dx2cube(1), a manual page for dx2cube 3.6.1+dfsg πŸ’… and honestly? she's a little icon.


✨ NAME ✨

dx2cube β€” literally just the manual page for dx2cube 3.6.1+dfsg, no notes πŸ’–


🌸 DESCRIPTION 🌸

here's the whole vibe, okay, look at her:

usage: dx2cube [-h] [--log-level {DEBUG,INFO,WARNING,ERROR,CRITICAL}]
       dx_input pqr_input output

so. PDB2PQR v3.6.1: biomolecular structure conversion software. and dx2cube? converting OpenDX-format files to Gaussian Cube format since (at least) 2015 🫢 she's been doing this since before some of us could read, no cap.

πŸŽ€ positional arguments πŸŽ€

these three are required, they're the main characters, give them their moment:

  • dx_input β€” the name of the dx_input file πŸ’œ
  • pqr_input β€” the name of the pqr_input file 🌸
  • output β€” the name of the output file ✨

πŸ‘‘ options πŸ‘‘

  • -h, --help β€” show this help message and exit. iconic behaviour, honestly 😭
  • --log-level {DEBUG,INFO,WARNING,ERROR,CRITICAL} β€” set logging level, and the default is INFO πŸ¦‹
ngl bestie, if you're ever confused, -h is right there. she will explain herself. that's the group chat energy we love 🫢

🌈 the sign-off 🌈

this is dx2cube 3.6.1+dfsg, dated June 2023, and that's the whole page πŸ’– periodt. go convert something and slay βœ¨πŸŽ€πŸ’…

πŸ“¦ where this page comes from