import numpy as np import sys import os N_arr = np.arange(6, 36, 2) # N_arr = np.append(N_arr, np.arange(41, 51, 1)) # _partition = 'hourly' # sim_pack = 'qiskit' # task = 'hdyn' # com_cap = 'st' # prec = 'dp' sim_pack = sys.argv[1] task = sys.argv[2] com_cap = sys.argv[3] prec = sys.argv[4] gen_path = os.path.abspath(os.getcwd()) + '/' par_dir_path = os.path.abspath(os.path.join(gen_path, os.pardir)) + '/' sim_path = par_dir_path + '/{}/'.format(sim_pack) for ind, N in enumerate(N_arr): with open('{}_{}_{}_{}.sh'.format(task, com_cap, prec, N), 'a') as job_file: job_file.write('#!/bin/bash -l\n') job_file.write('#SBATCH --job-name={}_{}_{}_{}_{}\n'.format(sim_pack, task, com_cap, prec, N)) if N < 26: job_file.write('#SBATCH --partition=hourly\n') else: job_file.write('#SBATCH --partition=general\n') if com_cap == 'st': job_file.write('#SBATCH --hint=nomultithread\n') job_file.write('#SBATCH --nodes=1\n') job_file.write('#SBATCH --ntasks=1\n') job_file.write('#SBATCH --cpus-per-task=1\n') job_file.write('#SBATCH --ntasks-per-core=1\n') elif com_cap == 'mt': job_file.write('#SBATCH --hint=multithread\n') job_file.write('#SBATCH --nodes=1\n') job_file.write('#SBATCH --ntasks=1\n') job_file.write('#SBATCH --cpus-per-task=42\n') job_file.write('#SBATCH --ntasks-per-core=2\n') if N < 26: job_file.write('#SBATCH --mem=30G\n') else: job_file.write('#SBATCH --mem=300G\n') if N < 26: job_file.write('#SBATCH --time=01:00:00\n') else: job_file.write('#SBATCH --time=23:00:00\n') # job_file.write('#SBATCH --mail-user=amit.gangapuram@psi.ch\n') # job_file.write('#SBATCH --mail-type=BEGIN,END,FAIL\n') # job_file.write('#SBATCH --output /data/user/gangap_a/{}_singular/{}/output_{}_{}/{}_{}_{}_{}.out\n'.format(task, sim_pack, com_cap, prec, task, com_cap, prec, N)) # job_file.write('#SBATCH --error /data/user/gangap_a/{}_singular/{}/error_{}_{}/{}_{}_{}_{}.err\n'.format(task, sim_pack, com_cap, prec, task, com_cap, prec, N)) job_file.write('\n\n') if sim_pack == 'projectq' or sim_pack == 'quest' or sim_pack == 'intel_qs_cpp' or sim_pack == 'svsim' or sim_pack == 'hybridq' or sim_pack == 'hiq' or sim_pack == 'qibo' or sim_pack == 'qibojit' or sim_pack == 'qrack_sch' or sim_pack == 'qrack_opt' or sim_pack == 'pennylane_l' or sim_pack == 'qpp' or sim_pack == 'qpanda' or sim_pack =='braket' or sim_pack == 'myqlm' or sim_pack == 'myqlm_cpp': if com_cap == 'st': job_file.write('OMP_NUM_THREADS=1\n') job_file.write('export OMP_NUM_THREADS\n') elif com_cap == 'mt': job_file.write('OMP_NUM_THREADS=84\n') job_file.write('export OMP_NUM_THREADS\n') job_file.write('export SRUN_CPUS_PER_TASK=$SLURM_CPUS_PER_TASK\n') else: job_file.write('export APPTAINER_BIND="{}bash_scripts_{}_{}/:/brf,{}run_files_{}_{}/:/home,{}data_{}_{}/\"\n'.format(par_dir_path, com_cap, prec, par_dir_path, com_cap, prec, par_dir_path, com_cap, prec)) if com_cap == 'gpu': job_file.write('singularity exec --nv /data/user/gangap_a/singularity_images/qucos_gpu_sim.sif bash /brf/{}_{}_{}_{}.sh\n'.format(task, com_cap, prec, N)) else: job_file.write('singularity exec /qucos_sim.sif bash /brf/{}_{}_{}_{}.sh\n'.format(task, com_cap, prec, N))