diff --git a/alignement.py b/alignement.py index 4e290fb52501fc7e04826d0fe063ad6b9d48506d..579c2c0b0cc2a261a4dfc5035c28bf9488ad0ef0 100644 --- a/alignement.py +++ b/alignement.py @@ -96,10 +96,10 @@ data_train = load_data('msms/msms24_01.txt').reset_index(drop=True) data_align = align(data_train, data_ori) data_align.to_pickle('database/data_DIA_24_01_aligned30_01.pkl') -# data_train = load_data('msms/msms30_01.txt').reset_index(drop=True) -# # data_train = pd.read_pickle('database/data_DIA_30_01.pkl').reset_index(drop=True) +data_train = load_data('msms/msms30_01.txt').reset_index(drop=True) +# data_train = pd.read_pickle('database/data_DIA_30_01.pkl').reset_index(drop=True) # data_align = align(data_train, data_ori) -# data_align.to_pickle('database/data_DIA_30_01_aligned30_01.pkl') +data_train.to_pickle('database/data_DIA_30_01_aligned30_01.pkl') # # plt.scatter(data_train['Retention time'], data_align['Retention time'], s=1) # plt.savefig('test_align_2.png') diff --git a/database/data_DIA_ISA_55_test_30_01.pkl b/database/data_DIA_ISA_55_test_30_01.pkl deleted file mode 100644 index b6091e333179587f777da5d16c2880e5bdda77d7..0000000000000000000000000000000000000000 Binary files a/database/data_DIA_ISA_55_test_30_01.pkl and /dev/null differ diff --git a/database/data_DIA_ISA_55_train_30_01.pkl b/database/data_DIA_ISA_55_train_30_01.pkl deleted file mode 100644 index 0ee7e1b319fa2376ae34864af21725b36c7ec267..0000000000000000000000000000000000000000 Binary files a/database/data_DIA_ISA_55_train_30_01.pkl and /dev/null differ