diff --git a/pcpostprocess/scripts/summarise_herg_export.py b/pcpostprocess/scripts/summarise_herg_export.py index 84e19c81..99c7ca12 100644 --- a/pcpostprocess/scripts/summarise_herg_export.py +++ b/pcpostprocess/scripts/summarise_herg_export.py @@ -59,7 +59,7 @@ def main(): parser.add_argument('--protocols', type=str, default=[], nargs='+') parser.add_argument('-r', '--reversal', type=float, default=np.nan) # parser.add_argument('--selection_file', default=None, type=str) - parser.add_argument('--experiment_name', default='newtonrun4') + parser.add_argument('--experiment_name', default='13112023_MW2') parser.add_argument('--figsize', type=int, nargs=2, default=[5, 3]) parser.add_argument('--output_all', action='store_true') parser.add_argument('--log_level', default='INFO') @@ -85,11 +85,11 @@ def main(): qc_styled_df = create_qc_table(qc_df) qc_styled_df = qc_styled_df.pivot(columns='protocol', index='crit') - qc_styled_df.to_excel(os.path.join(output_dir, 'qc_table.xlsx')) + # qc_styled_df.to_excel(os.path.join(output_dir, 'qc_table.xlsx')) qc_styled_df.to_latex(os.path.join(output_dir, 'qc_table.tex')) - qc_estimates_file = os.path.join(args.save_dir, f"{args.experiment_name}_subtraction_qc.csv") - qc_vals_df = pd.read_csv(os.path.join(qc_estimates_file)) + # qc_estimates_file = os.path.join(args.save_dir, f"{args.experiment_name}_subtraction_qc.csv") + # qc_vals_df = pd.read_csv(os.path.join(qc_estimates_file)) qc_df.protocol = ['staircaseramp1' if protocol == 'staircaseramp' else protocol for protocol in qc_df.protocol] @@ -131,9 +131,8 @@ def main(): categories=protocol_order, ordered=True) - qc_vals_df['protocol'] = pd.Categorical(qc_vals_df['protocol'], - categories=protocol_order, - ordered=True) + # qc_vals_df['protocol'] = pd.Categorical( + # qc_vals_df['protocol'], categories=protocol_order, ordered=True) leak_parameters_df.sort_values(['protocol', 'sweep'], inplace=True) except FileNotFoundError as exc: @@ -161,10 +160,10 @@ def main(): plot_spatial_Erev(leak_parameters_df) leak_parameters_df['passed QC'] = [well in passed_wells for well in leak_parameters_df.well] - qc_vals_df['passed QC'] = [well in passed_wells for well in qc_vals_df.well] + # qc_vals_df['passed QC'] = [well in passed_wells for well in qc_vals_df.well] # do_scatter_matrices(leak_parameters_df, qc_vals_df) - plot_histograms(leak_parameters_df, qc_vals_df) + plot_histograms(leak_parameters_df) # Very resource intensive # overlay_reversal_plots(leak_parameters_df) @@ -235,7 +234,7 @@ def scatterplot_timescale_E_obs(df): ax.set_ylabel(r'$\tau$ (ms)') ax.set_xlabel(r'$E_\mathrm{obs}$') - fig.savefig(os.path.join(output_dir, "decay_timescale_vs_E_rev_scatter.pdf")) + fig.savefig(os.path.join(output_dir, "decay_timescale_vs_E_rev_scatter.png")) ax.cla() sns.lineplot(data=plot_df, y='40mV decay time constant', @@ -245,7 +244,7 @@ def scatterplot_timescale_E_obs(df): ax.set_ylabel(r'$\tau$ (ms)') ax.set_xlabel(r'$E_\mathrm{obs}$') ax.spines[['top', 'right']].set_visible(False) - fig.savefig(os.path.join(output_dir, "decay_timescale_vs_E_rev_line.pdf")) + fig.savefig(os.path.join(output_dir, "decay_timescale_vs_E_rev_line.png")) ax.cla() plot_df['E_rev'] = (plot_df.set_index('well')['E_rev'] - plot_df.groupby('well') @@ -257,7 +256,7 @@ def scatterplot_timescale_E_obs(df): ax.set_ylabel(r'$E_\mathrm{leak} - \bar E_\mathrm{leak}$ (ms)') ax.set_xlabel(r'$E_\mathrm{obs} - \bar E_\mathrm{obs}$') - fig.savefig(os.path.join(output_dir, "E_leak_vs_E_rev_scatter.pdf")) + fig.savefig(os.path.join(output_dir, "E_leak_vs_E_rev_scatter.png")) ax.cla() @@ -336,8 +335,7 @@ def label_func(p, s): legend_handles, _ = ax.get_legend_handles_labels() ax.legend(legend_handles, ['failed QC', 'passed QC'], bbox_to_anchor=(1.26, 1)) - fig.savefig(os.path.join(sub_dir, f"{var.replace(' ', '_')}.pdf"), - format='pdf') + fig.savefig(os.path.join(sub_dir, f"{var.replace(' ', '_')}.png")) ax.cla() plt.close(fig) @@ -477,8 +475,7 @@ def do_scatter_matrices(df, qc_df): grid = sns.pairplot(data=df, hue='hue', diag_kind='hist', plot_kws={'alpha': 0.4, 'edgecolor': None}, hue_order=[True, False]) - grid.savefig(os.path.join(output_dir, 'scatter_matrix_by_reversal.pdf'), - format='pdf') + grid.savefig(os.path.join(output_dir, 'scatter_matrix_by_reversal.png')) # Now do artefact parameters only if 'drug' in qc_df: @@ -656,8 +653,7 @@ def func(protocol, sweep): # Put 'A' row at the top ax.invert_yaxis() - fig.savefig(os.path.join(output_dir, f"{protocol}_sweep{sweep}_E_Kr_map.pdf"), - format='pdf') + fig.savefig(os.path.join(output_dir, f"{protocol}_sweep{sweep}_E_Kr_map.png")) plt.close(fig) protocol = 'staircaseramp1' @@ -696,12 +692,12 @@ def plot_spatial_passed(df): ax.set_yticklabels(string.ascii_uppercase[:16]) ax.invert_yaxis() - fig.savefig(os.path.join(output_dir, "QC_map.pdf"), format='pdf') + fig.savefig(os.path.join(output_dir, "QC_map.png")) plt.close(fig) -def plot_histograms(df, qc_df): +def plot_histograms(df): fig = plt.figure(figsize=args.figsize, constrained_layout=True) ax = fig.subplots() @@ -896,20 +892,22 @@ def create_attrition_table(qc_df, subtraction_df): 'qc6.subtracted', 'qc6.1.subtracted', 'qc6.2.subtracted'] - subtraction_df_sc = subtraction_df[subtraction_df.protocol.isin(['staircaseramp1', - 'staircaseramp1_2'])] - R_leftover_qc = subtraction_df_sc.groupby('well')['R_leftover'].max() < 0.4 + # subtraction_df_sc = subtraction_df[ + # subtraction_df.protocol.isin(['staircaseramp1', 'staircaseramp1_2'])] - qc_df['QC.R_leftover'] = [R_leftover_qc.loc[well] for well in subtraction_df.well.unique()] + # R_leftover_qc = subtraction_df_sc.groupby('well')['R_leftover'].max() < 0.4 + + # This line doesn't work: "Length of values does not match length of index" + # qc_df['QC.R_leftover'] = [R_leftover_qc.loc[well] for well in subtraction_df.well.unique()] stage_3_criteria = original_qc_criteria + ['QC1.all_protocols', 'QC4.all_protocols', 'QC6.all_protocols'] stage_4_criteria = stage_3_criteria + ['qc3.bookend'] stage_5_criteria = stage_4_criteria + ['QC.Erev.all_protocols', 'QC.Erev.spread'] - stage_6_criteria = stage_5_criteria + ['QC.R_leftover'] + # stage_6_criteria = stage_5_criteria + ['QC.R_leftover'] - agg_dict = {crit: 'min' for crit in stage_6_criteria} + agg_dict = {crit: 'min' for crit in stage_5_criteria} qc_df_sc1 = qc_df[qc_df.protocol == 'staircaseramp1'] print(qc_df_sc1.values.shape) @@ -935,11 +933,11 @@ def create_attrition_table(qc_df, subtraction_df): .agg(agg_dict)[stage_5_criteria].values, axis=1)) - n_stage_6_wells = np.sum(np.all(qc_df.groupby('well') - .agg(agg_dict)[stage_6_criteria].values, - axis=1)) + # n_stage_6_wells = np.sum(np.all(qc_df.groupby('well') + # .agg(agg_dict)[stage_6_criteria].values, + # axis=1)) - passed_qc_df = qc_df.groupby('well').agg(agg_dict)[stage_6_criteria] + passed_qc_df = qc_df.groupby('well').agg(agg_dict)[stage_5_criteria] print(passed_qc_df) passed_wells = [well for well, row in passed_qc_df.iterrows() if np.all(row.values)] @@ -951,7 +949,7 @@ def create_attrition_table(qc_df, subtraction_df): 'stage3': [n_stage_3_wells], 'stage4': [n_stage_4_wells], 'stage5': [n_stage_5_wells], - 'stage6': [n_stage_6_wells], + # 'stage6': [n_stage_6_wells], } res_df = pd.DataFrame.from_records(res_dict) diff --git a/summarise-all/summarise_herg_export/Cm_before.png b/summarise-all/summarise_herg_export/Cm_before.png new file mode 100644 index 00000000..92d2a332 Binary files /dev/null and b/summarise-all/summarise_herg_export/Cm_before.png differ diff --git a/summarise-all/summarise_herg_export/E_leak_vs_E_rev_scatter.png b/summarise-all/summarise_herg_export/E_leak_vs_E_rev_scatter.png new file mode 100644 index 00000000..d6d9d9c4 Binary files /dev/null and b/summarise-all/summarise_herg_export/E_leak_vs_E_rev_scatter.png differ diff --git a/summarise-all/summarise_herg_export/E_rev_sweep_to_sweep_staircaseramp1.png b/summarise-all/summarise_herg_export/E_rev_sweep_to_sweep_staircaseramp1.png new file mode 100644 index 00000000..37e8b243 Binary files /dev/null and b/summarise-all/summarise_herg_export/E_rev_sweep_to_sweep_staircaseramp1.png differ diff --git a/summarise-all/summarise_herg_export/E_rev_sweep_to_sweep_staircaseramp1_2.png b/summarise-all/summarise_herg_export/E_rev_sweep_to_sweep_staircaseramp1_2.png new file mode 100644 index 00000000..b218c4e0 Binary files /dev/null and b/summarise-all/summarise_herg_export/E_rev_sweep_to_sweep_staircaseramp1_2.png differ diff --git a/summarise-all/summarise_herg_export/QC_map.png b/summarise-all/summarise_herg_export/QC_map.png new file mode 100644 index 00000000..358a5579 Binary files /dev/null and b/summarise-all/summarise_herg_export/QC_map.png differ diff --git a/summarise-all/summarise_herg_export/R_leftover.png b/summarise-all/summarise_herg_export/R_leftover.png new file mode 100644 index 00000000..72136f28 Binary files /dev/null and b/summarise-all/summarise_herg_export/R_leftover.png differ diff --git a/summarise-all/summarise_herg_export/Rseal_before.png b/summarise-all/summarise_herg_export/Rseal_before.png new file mode 100644 index 00000000..27a81815 Binary files /dev/null and b/summarise-all/summarise_herg_export/Rseal_before.png differ diff --git a/summarise-all/summarise_herg_export/Rseries_before.png b/summarise-all/summarise_herg_export/Rseries_before.png new file mode 100644 index 00000000..2188361f Binary files /dev/null and b/summarise-all/summarise_herg_export/Rseries_before.png differ diff --git a/summarise-all/summarise_herg_export/attrition.tex b/summarise-all/summarise_herg_export/attrition.tex new file mode 100644 index 00000000..98f05969 --- /dev/null +++ b/summarise-all/summarise_herg_export/attrition.tex @@ -0,0 +1,7 @@ +\begin{tabular}{lrrrrr} +\toprule + & stage1 & stage2 & stage3 & stage4 & stage5 \\ +\midrule +0 & 58 & 26 & 26 & 14 & 14 \\ +\bottomrule +\end{tabular} diff --git a/summarise-all/summarise_herg_export/averaged_reversal_potential_histogram.png b/summarise-all/summarise_herg_export/averaged_reversal_potential_histogram.png new file mode 100644 index 00000000..9b5492a1 Binary files /dev/null and b/summarise-all/summarise_herg_export/averaged_reversal_potential_histogram.png differ diff --git a/summarise-all/summarise_herg_export/chrono_plots/-120mV_decay_time_constant_1.png b/summarise-all/summarise_herg_export/chrono_plots/-120mV_decay_time_constant_1.png new file mode 100644 index 00000000..54220b74 Binary files /dev/null and b/summarise-all/summarise_herg_export/chrono_plots/-120mV_decay_time_constant_1.png differ diff --git a/summarise-all/summarise_herg_export/chrono_plots/-120mV_decay_time_constant_2.png b/summarise-all/summarise_herg_export/chrono_plots/-120mV_decay_time_constant_2.png new file mode 100644 index 00000000..8e3877cd Binary files /dev/null and b/summarise-all/summarise_herg_export/chrono_plots/-120mV_decay_time_constant_2.png 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b/summarise-all/summarise_herg_export/pcpostprocess_info.txt new file mode 100644 index 00000000..003f294e --- /dev/null +++ b/summarise-all/summarise_herg_export/pcpostprocess_info.txt @@ -0,0 +1,6 @@ +pcpostprocess output https://github.com/CardiacModelling/pcpostprocess +Date: 2025-11-12 15:10:51.794995 +Version: 0.2.1.dev1 +Build type: Develop +Commit: g62a0bd564 +Command: pcpostprocess summarise_herg_export output-all --experiment_name=13112023_MW2 --output_dir=summarise-all diff --git a/summarise-all/summarise_herg_export/post_drug_leak_magnitude.png b/summarise-all/summarise_herg_export/post_drug_leak_magnitude.png new file mode 100644 index 00000000..2d082ca0 Binary files /dev/null and b/summarise-all/summarise_herg_export/post_drug_leak_magnitude.png differ diff --git a/summarise-all/summarise_herg_export/pre_drug_leak_magnitude.png b/summarise-all/summarise_herg_export/pre_drug_leak_magnitude.png new file mode 100644 index 00000000..554ab6bd Binary files /dev/null and b/summarise-all/summarise_herg_export/pre_drug_leak_magnitude.png differ diff --git a/summarise-all/summarise_herg_export/qc_table.tex b/summarise-all/summarise_herg_export/qc_table.tex new file mode 100644 index 00000000..20337c94 --- /dev/null +++ b/summarise-all/summarise_herg_export/qc_table.tex @@ -0,0 +1,31 @@ +\begin{tabular}{lrrr} +\toprule + & \multicolumn{3}{r}{wells failing} \\ +protocol & staircaseramp1 & staircaseramp1_2 & all \\ +crit & & & \\ +\midrule +QC.Erev.all\_protocols & 384 & 384 & 0 \\ +QC.Erev.spread & 384 & 384 & 0 \\ +QC1.all\_protocols & 384 & 384 & 0 \\ +QC4.all\_protocols & 384 & 384 & 0 \\ +QC6.all\_protocols & 384 & 384 & 0 \\ +all & 384 & 384 & 370 \\ +qc1.cm & 384 & 384 & 140 \\ +qc1.rseal & 384 & 384 & 188 \\ +qc1.rseries & 384 & 384 & 199 \\ +qc2.raw & 384 & 384 & 4 \\ +qc2.subtracted & 384 & 384 & 47 \\ +qc3.E4031 & 384 & 384 & 73 \\ +qc3.bookend & 384 & 384 & 287 \\ +qc3.raw & 384 & 384 & 135 \\ +qc3.subtracted & 384 & 384 & 183 \\ +qc4.cm & 384 & 384 & 142 \\ +qc4.rseal & 384 & 384 & 72 \\ +qc4.rseries & 384 & 384 & 152 \\ +qc5.1.staircase & 384 & 384 & 212 \\ +qc5.staircase & 384 & 384 & 80 \\ +qc6.1.subtracted & 384 & 384 & 226 \\ +qc6.2.subtracted & 384 & 384 & 215 \\ +qc6.subtracted & 384 & 384 & 239 \\ +\bottomrule +\end{tabular} diff --git a/summarise-all/summarise_herg_export/reversal_potential_histogram.png b/summarise-all/summarise_herg_export/reversal_potential_histogram.png new file mode 100644 index 00000000..9b5492a1 Binary files /dev/null and b/summarise-all/summarise_herg_export/reversal_potential_histogram.png differ diff --git a/summarise-all/summarise_herg_export/spread_of_fitted_E_Kr.csv b/summarise-all/summarise_herg_export/spread_of_fitted_E_Kr.csv new file mode 100644 index 00000000..5e3d9fcf --- /dev/null +++ b/summarise-all/summarise_herg_export/spread_of_fitted_E_Kr.csv @@ -0,0 +1,105 @@ +,Unnamed: 0,well,sweep,protocol,Rseal,Cm,Rseries,gleak_before,E_leak_before,gleak_after,E_leak_after,R_leftover,QC.R_leftover,E_rev,E_rev_before,E_rev_after,QC.Erev,QC6,QC1,QC4,total before-drug flux,-120mV decay time constant 1,-120mV decay time constant 2,-120mV decay time constant 3,-120mV peak current,selected,passed QC,QC.Erev.spread,Erev_spread,pre-drug leak magnitude,post-drug leak magnitude +0,0,A03,0,staircaseramp1,3251069000.0,1.58413e-11,9491014.0,0.7345540279467161,-41.11296239757151,0.9292715112232074,-36.35961095388226,0.0448087589160295,True,-90.74636825355324,-89.57184330525791,-90.46261999707303,True,True,True,True,13417254.586416584,423.5588520365207,71.82414041774116,150.70295323575797,-1075.5094804921905,True,True,True,4.098624786642645,45.54131947767759,50.464018297285634 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