import itertools aa_set = {"A", "C", "D", "E", "F", "G", "H", "I", "K", "L", "M", "N", "P", "Q", "R", "S", "T", "V", "W", "Y"} aa_list = ["A", "C", "D", "E", "F", "G", "H", "I", "K", "L", "M", "N", "P", "Q", "R", "S", "T", "V", "W", "Y"] foldseek_seq_vocab = "ACDEFGHIKLMNPQRSTVWY#" foldseek_struc_vocab = "pynwrqhgdlvtmfsaeikc#" struc_unit = "abcdefghijklmnopqrstuvwxyz" def create_vocab(size: int) -> dict: """ Args: size: Size of the vocabulary Returns: vocab: Vocabulary """ token_len = 1 while size > len(struc_unit) ** token_len: token_len += 1 vocab = {} for i, token in enumerate(itertools.product(struc_unit, repeat=token_len)): vocab[i] = "".join(token) if len(vocab) == size: vocab[i+1] = "#" return vocab # ProTrek residue_level = {"Active site", "Binding site", "Site", "DNA binding", "Natural variant", "Mutagenesis", "Transmembrane", "Topological domain", "Intramembrane", "Signal peptide", "Propeptide", "Transit peptide", "Chain", "Peptide", "Modified residue", "Lipidation", "Glycosylation", "Disulfide bond", "Cross-link", "Domain", "Repeat", "Compositional bias", "Region", "Coiled coil", "Motif"} sequence_level = {"Function", "Miscellaneous", "Caution", "Catalytic activity", "Cofactor", "Activity regulation", "Biophysicochemical properties", "Pathway", "Involvement in disease", "Allergenic properties", "Toxic dose", "Pharmaceutical use", "Disruption phenotype", "Subcellular location", "Post-translational modification", "Subunit", "Domain (non-positional annotation)", "Sequence similarities", "RNA Editing", "Tissue specificity", "Developmental stage", "Induction", "Biotechnology", "Polymorphism", "GO annotation", "Proteomes", "Protein names", "Gene names", "Organism", "Taxonomic lineage", "Virus host"} raw_text_level = {"Function", "Subunit", "Tissue specificity", "Disruption phenotype", "Post-translational modification", "Induction", "Miscellaneous", "Sequence similarities", "Developmental stage", "Domain (non-positional annotation)", "Activity regulation", "Caution", "Polymorphism", "Toxic dose", "Allergenic properties", "Pharmaceutical use", "Cofactor", "Biophysicochemical properties", "Subcellular location", "RNA Editing"}