diff --git a/mhcflurry/affinity_measurement_dataset.py b/mhcflurry/affinity_measurement_dataset.py index 757e51ed7895924a7f040873f43b7f76fb09b52b..724442193342e2bdd031edf86760acd148399f2f 100644 --- a/mhcflurry/affinity_measurement_dataset.py +++ b/mhcflurry/affinity_measurement_dataset.py @@ -757,7 +757,7 @@ class AffinityMeasurementDataset(object): (k in keys_to_remove_set) for k in zip(self.alleles, self.peptides) ]) - keep_mask = ~remove_mask + keep_mask = remove_mask == False return self.slice(keep_mask) def difference(self, other_dataset): diff --git a/mhcflurry/antigen_presentation/presentation_model.py b/mhcflurry/antigen_presentation/presentation_model.py index 73c1f68832fe464f24491104850cd9babae51fa0..25506498024e2575073b473e4ba169a1450cd5f0 100644 --- a/mhcflurry/antigen_presentation/presentation_model.py +++ b/mhcflurry/antigen_presentation/presentation_model.py @@ -422,6 +422,8 @@ class PresentationModel(object): assert 'experiment_name' in peptides_df.columns assert 'hit' in peptides_df.columns + peptides_df = peptides_df.copy() + peptides_df["prediction"] = self.predict(peptides_df) top_n = float(peptides_df.hit.sum()) @@ -432,8 +434,13 @@ class PresentationModel(object): } else: ranks = peptides_df.prediction.rank(ascending=False) + hit_indices = ranks[peptides_df.hit > 0].values + hit_lengths = peptides_df.peptide[ + peptides_df.hit > 0 + ].str.len().values result = { - 'hit_indices': numpy.sort(ranks[peptides_df.hit > 0].values), + 'hit_indices': hit_indices, + 'hit_lengths': hit_lengths, 'total_peptides': len(peptides_df), } result['score'] = ( @@ -572,5 +579,5 @@ def ensemble_predictions(models, peptides_df, mask_indices_list=None): values = panel.ix[:, :, col] assert values.shape == (len(peptides_df), len(models)) result[col] = model.combine_ensemble_predictions(col, values.values) - assert_no_null(result[col]) + assert_no_null(pandas.Series(result[col])) return result diff --git a/mhcflurry/common.py b/mhcflurry/common.py index cc21280eea4e3e5ccd8a2b3ab1007a4292ccc2da..da205c34d910740c32fbe421df9c7ec485d50180 100644 --- a/mhcflurry/common.py +++ b/mhcflurry/common.py @@ -188,8 +188,8 @@ def describe_nulls(df, related_df_with_same_index_to_describe=None): if isinstance(df, pandas.Series): df = df.to_frame() with pandas.option_context('mode.use_inf_as_null', True): - null_counts_by_col = df.isnull().sum(axis=0) - null_rows = df.isnull().sum(axis=1) > 0 + null_counts_by_col = pandas.isnull(df).sum(axis=0) + null_rows = pandas.isnull(df).sum(axis=1) > 0 return ( "Columns with nulls:\n%s, related rows with nulls:\n%s, " "full df:\n%s" % ( diff --git a/mhcflurry/data/class1_pseudosequences.csv b/mhcflurry/data/class1_pseudosequences.csv new file mode 100644 index 0000000000000000000000000000000000000000..7bcb52de0731e3086efd98211129d1d671963be2 --- /dev/null +++ b/mhcflurry/data/class1_pseudosequences.csv @@ -0,0 +1,2916 @@ +allele,pseudosequence +HLA-A*01:01,YFAMYQENMAHTDANTLYIIYRDYTWVARVYRGY 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