# Copyright (c) Microsoft Corporation. # Licensed under the MIT License. import json import logging import hydra import omegaconf import torch from omegaconf import OmegaConf from mattergen.common.utils.globals import MODELS_PROJECT_ROOT from mattergen.diffusion.config import Config from mattergen.diffusion.run import main logger = logging.getLogger(__name__) @hydra.main( config_path=str(MODELS_PROJECT_ROOT / "conf"), config_name="default", version_base="1.1" ) def mattergen_main(cfg: omegaconf.DictConfig): # Tensor Core acceleration (leads to ~2x speed-up during training) torch.set_float32_matmul_precision("high") # Make merged config options # CLI options take priority over YAML file options schema = OmegaConf.structured(Config) config = OmegaConf.merge(schema, cfg) OmegaConf.set_readonly(config, True) # should not be written to print(OmegaConf.to_yaml(cfg, resolve=True)) main(config) if __name__ == "__main__": mattergen_main()