From a4cf7436dc0016b3e9373bdb62f8acb88adf81de Mon Sep 17 00:00:00 2001 From: Ilyes Batatia <48651863+ilyes319@users.noreply.github.com> Date: Fri, 15 Nov 2024 11:10:27 +0000 Subject: [PATCH] fix train_file and valid_file in mace_mp_0b --- mace_mp_0b/mace-agnesi-small.sh | 6 +++--- 1 file changed, 3 insertions(+), 3 deletions(-) diff --git a/mace_mp_0b/mace-agnesi-small.sh b/mace_mp_0b/mace-agnesi-small.sh index 17aaa47..8fbbfa1 100644 --- a/mace_mp_0b/mace-agnesi-small.sh +++ b/mace_mp_0b/mace-agnesi-small.sh @@ -1,8 +1,8 @@ srun python mace/mace/cli/run_train.py \ --name="MACE_large_agnesi" \ - --train_file=".../mace_large_hp/mace_mp_data/train" \ - --valid_file=".../mace_large_hp/mace_mp_data/valid" \ - --statistics_file=".../mace_mp_data/mptrj-gga-ggapu-statistics.json" \ + --train_file=".../train" \ + --valid_file=".../valid" \ + --statistics_file=".../mptrj-gga-ggapu-statistics.json" \ --loss='universal' \ --energy_weight=1 \ --forces_weight=10 \