#!/bin/bash # submit_all.sh , fire off the entire revision experiment matrix on CCC. # # Submits 6 array jobs (one bsub call per .bsub file). Total job count: # ★_G ridge : 18 (6 targets × 3 seeds) # ★_G neural : 18 # MLPs : 54 (3 modes × 6 targets × 3 seeds) # SchNet : 12 (4 scalar targets × 3 seeds) # e3nn : 18 # MACE : 18 # ---------------- # Total : 138 array slots # # Run from the python/large_scale directory: # cd ~/starg/python/large_scale # bash bsub/submit_all.sh set -euo pipefail HERE="$(dirname "$0")" bsub < "$HERE/submit_starg_ridge.bsub" bsub < "$HERE/submit_starg_neural.bsub" bsub < "$HERE/submit_mlp.bsub" bsub < "$HERE/submit_schnet.bsub" bsub < "$HERE/submit_e3nn.bsub" bsub < "$HERE/submit_mace.bsub" echo echo "[done] all array jobs submitted. Watch with: bjobs" echo " once finished, run: python eval_collect.py"