DEFAULT_PARQUET_ENGINE = "pyarrow" retention_time_pipeline_parameters = { "model_params": {"seq_length": 30}, "data_params": { "seq_length": 30, }, "trained_model_path": "../pretrained_models/retention_time/example_rtmodel/", "trained_model_zipfile_name": "rtmodel.zip", "trained_model_stats": [0.0, 1.0], } retention_time_pipeline_parameters.update( { "trained_model_url": "https://raw.githubusercontent.com/wilhelm-lab/dlomix/develop" + retention_time_pipeline_parameters["trained_model_path"].strip("..") + retention_time_pipeline_parameters["trained_model_zipfile_name"] } ) ALPHABET_UNMOD = { "A": 1, "C": 2, "D": 3, "E": 4, "F": 5, "G": 6, "H": 7, "I": 8, "K": 9, "L": 10, "M": 11, "N": 12, "P": 13, "Q": 14, "R": 15, "S": 16, "T": 17, "V": 18, "W": 19, "Y": 20, } # relevant for feature extraction for PTMs, only for reference ALPHABET_PTMS = { "A": 1, "C": 2, "D": 3, "E": 4, "F": 5, "G": 6, "H": 7, "I": 8, "K": 9, "L": 10, "M": 11, # amino acids "N": 12, "P": 13, "Q": 14, "R": 15, "S": 16, "T": 17, "V": 18, "W": 19, "Y": 20, "[]-": 21, "-[]": 22, # termini "M[UNIMOD:35]": 23, "S[UNIMOD:21]": 24, "T[UNIMOD:21]": 25, "Y[UNIMOD:21]": 26, "R[UNIMOD:7]": 27, "K[UNIMOD:1]": 28, "K[UNIMOD:121]": 29, "Q(gl)": 30, "R[UNIMOD:34]": 31, "K[UNIMOD:34]": 32, "T(ga)": 33, "S(ga)": 34, "T(gl)": 35, "S(gl)": 36, "C[UNIMOD:4]": 37, "E(gl)": 39, "[ac]-": 38, "K[UNIMOD:36]": 40, "K[UNIMOD:37]": 41, "K[UNIMOD:122]": 42, "K[UNIMOD:58]": 43, "K[UNIMOD:1289]": 44, "K[UNIMOD:747]": 45, "K[UNIMOD:64]": 46, "K[UNIMOD:1848]": 47, "K[UNIMOD:1363]": 48, "K[UNIMOD:1849]": 49, "K[UNIMOD:3]": 50, "R[UNIMOD:36]": 51, "R[UNIMOD:36a]": 52, "P[UNIMOD:35]": 53, "Y[UNIMOD:354]": 54, }