mp_20_pxrdnet / scripts /conditional_generation_experimental.sh
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python -W ignore conditional_generation.py \
--model_path /home/gabeguo/cdvae_xrd/outputs/singlerun/2024-09-11/mp_20_sinc100_EXPERIMENTAL_TEST \
--num_starting_points 100 \
--num_candidates 10 \
--lr 0.1 \
--min_lr 1e-4 \
--l2_penalty 2e-4 \
--num_tested_materials 50 \
--label experimental_sinc100Filter_ \
--num_gradient_steps 5000 \
--num_atom_lambda 0.1 \
--n_step_each 100 \
--composition_lambda 0.1 \
--l1_loss \
--output_dir paper_results_PRELIM