XPLOR

Aliases: XPLOR-NIH, X-PLOR

Provenance: commit b0a0f36ba4 · authored 2026-02-12T14:54:29+01:00 · agent claude-code · model sonnet

1 source · not in taxonomy (canonical name didn't match any upstream)

Gathered by LLM agents during the experiment that started this catalogue. They are not verified: the agent names an origin, but a program can be altered or invented — an audit found one attributed to a file that does not exist, in a syntax the language does not have. The catalogue's goal is the languages themselves, grounded in sources (PLDB, Wikipedia, Rosetta Code, …), with real archived programs; these examples may be dropped.

remarks Simple XPLOR example - energy minimization
remarks Define molecular topology

topology
  @toppar/protein.top
end

parameter
  @toppar/protein.par
end

structure @coordinates.psf end

coordinates @coordinates.pdb

flags exclude * include bond angle improper vdw elec end

minimize powell
  nstep=100
  drop=10.0
end

print energy end

stop