# config.py from fuson_plm.utils.logging import CustomParams CLEAN = CustomParams( ### Changing these parameters is not recommended FODB_PATH = '../data/raw_data/FOdb_all.csv', # path to raw FOdb database FODB_PUNCTA_PATH = '../data/raw_data/FOdb_puncta.csv', # path to raw FOdb puncta experimental data FUSIONPDB_PATH = '../data/raw_data/FusionPDB.txt', # path to raw FusionPDB Level 1 .txt download ) # Clustering Parameters CLUSTER = CustomParams( MAX_SEQ_LENGTH = 2000, # INCLUSIVE max length (amino acids) of a sequence for training, validation, or testing # MMSeqs2 parameters: see GitHub or MMSeqs2 Wiki for guidance MIN_SEQ_ID = 0.3, # % identity C = 0.8, # % sequence length overlap COV_MODE = 0, # cov-mode: 0 = bidirectional, 1 = target coverage, 2 = query coverage, 3 = target-in-query length coverage. # File paths INPUT_PATH = '../data/fuson_db.csv', PATH_TO_MMSEQS = '../mmseqs' # path to where you installed MMSeqs2 ) # Splitting Parameters # We randomly split clusters in two rounds to arrive at a Train, Validation, and Test set. # Round 1) All clusters -> Train (final) and Other (temp). Round 2) Other (temp) clusters -> Val (final) and Test (final) SPLIT = CustomParams( FUSON_DB_PATH = '../data/fuson_db.csv', CLUSTER_OUTPUT_PATH = '../data/clustering/mmseqs_full_results.csv', RANDOM_STATE_1 = 2, # random_state_1 = state for splitting all data into train & other TEST_SIZE_1 = 0.18, # test size for data -> train/test split. e.g. 20 means 80% clusters in train, 20% clusters in other RANDOM_STATE_2 = 6, # random_state_2 = state for splitting other from ^ into val and test TEST_SIZE_2 = 0.44 # test size for train -> train/val split. e.g. 0.50 means 50% clusters in train, 50% clusters in test )