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Update src/bin/binding_affinity_estimator.py
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src/bin/binding_affinity_estimator.py
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@@ -3,6 +3,12 @@ import multiprocessing
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import pandas as pd
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import numpy as np
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import scipy.stats
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from sklearn import linear_model
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from sklearn.model_selection import KFold
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@@ -154,7 +160,8 @@ def predictAffinityWithModel(regressor_model,multiplied_vectors_df):
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validation_corr_pval_list,
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)
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ppi_affinity_df = pd.read_csv(ppi_affinity_file,sep="\t",header=None)
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ppi_affinity_df.columns = ['Protein1', 'Protein2', 'Affinity']
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import pandas as pd
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import numpy as np
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import scipy.stats
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import os
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import sys
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script_dir = os.path.dirname(os.path.abspath(__file__))
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sys.path.append('..')
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sys.path.append('.')
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from sklearn import linear_model
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from sklearn.model_selection import KFold
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validation_corr_pval_list,
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)
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ppi_affinity_file_path = "../data/auxilary_input/skempi_pipr/SKEMPI_all_dg_avg.txt"
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ppi_affinity_file = os.path.join(script_dir, ppi_affinity_file_ath)
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ppi_affinity_df = pd.read_csv(ppi_affinity_file,sep="\t",header=None)
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ppi_affinity_df.columns = ['Protein1', 'Protein2', 'Affinity']
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