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paper-releases/pbisc-diffusion/updates/20260930T065633Z-summary-deck-scsemi-final/diffusion/dataset/server_1/model8/plans/paired_finetune_intradataset_20260927/scores/ji2025_chili/fewshot_n5/draw2_scsemi5/README.md ADDED
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+ # score_ft.py output: ji2025_chili, 26 scored donors
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+
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+ Arms: scsemi5. Every arm is scored on the same donors against the same observed reference.
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+
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+ ## Inputs and fixed contracts
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+ - Observed reference: `/home/sj_server_1/PBISC/immun-pbmc-fm/model_8_sparse_data_diffusion/plans/paired_finetune_intradataset_20260927/scoring_cache/ji2025_chili/reference.npz` (sha 19c30f56db69), built from datadir:/home/sj_server_1/PBISC/immun-pbmc-fm/model_8_sparse_data_diffusion/plans/paired_finetune_intradataset_20260927/data/ji2025_chili;
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+ observed cells sum exactly to the features pseudobulk of every donor. Observed labels: /home/sj_server_1/PBISC/immun-pbmc-fm/model_8_sparse_data_diffusion/plans/paired_finetune_intradataset_20260927/scoring_cache/ji2025_chili/observed_labels/labels/labels.parquet.
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+ - Generated cells: `generated_counts` read out once with Poisson(seed 20260916) over the **whole NPZ in row order**
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+ (`poisson_readout.poisson_integerise`), then the scored donors' rows. These integer counts are used for labels, embedding,
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+ depth and the contrast. Pseudobulk uses the summed `generated_counts` (rates), as `score_generated.py`.
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+ - Labels: frozen f01common scANVI (`predict_scanvi.py`, CPU, zero query epochs), six-type gate ['T cell', 'B cell', 'Monocyte', 'NK cell', 'DC', 'Other']; query genes =
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+ the 1,006-gene annotation list minus genes the dataset's sc assay did not measure in every sample (1004 genes).
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+ - Scoring genes: 6k panel genes measured by both assays in every sample of the dataset (5752 genes).
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+
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+ ## Definitions
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+ 1. **Composition**: fraction of each donor's cells per six-type label (all generated cells; all observed QC cells).
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+ `comp_l1` = sum over the six labels of |generated - observed| (immicro_common.l1). `comp_l1_obs_loo_null` = L1 of the
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+ donor's observed composition to the mean of the *other scored donors'* observed compositions. `composition_top1` =
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+ fraction of donors whose generated composition is closest (L1) to their own observed composition.
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+ 2. **Pseudobulk**: `pb_r` = Pearson r of CPM-log1p(summed generated_counts) vs CPM-log1p(observed pseudobulk) on the scoring
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+ genes (evaluate_realbulk.cpm_log1p / paired_r). `pb_top1` = the donor's generated pseudobulk is closest (Pearson) to its own
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+ observed pseudobulk among the 26 scored donors (immicro_common.retrieval = evaluate_realbulk.top1 arithmetic).
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+ 3. **Precision / coverage / density** (stage_b_embed.py functions): per-cell CP10K over the scoring genes + log1p; PCA-50
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+ (randomized, random_state 20260925) and k = 10 real-real k-NN balls fitted on **R1 of the scored donors only**.
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+ Reference rule (independent of fold and arm): per donor, cells in canonical order (library_id+barcode), one
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+ permutation from `default_rng([20260925, uint64(sha256(donor)[:8])])`; R1 = first n, R2 = next n,
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+ n = min(150, n_cells // 2) (3900 R1 cells here). Generated query: per donor n cells (the donor's R1 size),
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+ without replacement, `default_rng([20260926, same key])`. Precision = fraction of generated cells inside any R1 ball
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+ (Kynkaanniemi 2019); coverage = fraction of R1 cells whose ball holds a generated cell; density = Naeem 2020.
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+ Per-donor precision = that donor's generated cells; per-donor coverage = that donor's R1 cells (the pooled values are
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+ their n-weighted means; plain means when every donor has 150 reference cells). R2 (held-out real cells of the same donors) is the
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+ perfect-generator control: precision 0.9969, coverage 1.0000.
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+ **Depth matched**: stage_b_embed depth matching run pairwise (R1 vs this arm): per donor and within-donor rank of detected
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+ genes, both cells are thinned by UMI sampling without replacement to the smaller detected-gene count; PCA kept from
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+ un-thinned R1, radii recomputed on thinned R1; fresh rng(20260929) per arm. R2 control: precision
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+ 0.9972, coverage 1.0000.
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+ 4. **Monocyte %** = 100 x Monocyte fraction (all cells) per donor; **median UMI per cell** = median over cells of the
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+ Poisson-read (generated) / observed counts summed over the scoring genes (per donor, and pooled).
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+ 5. **Group contrast** (T, B, Monocyte, NK): case groups ['TOL', 'FU1'] (n = 16) vs control groups ['BC', 'AC'] (n = 10); rule: explicit --case-groups / --control-groups; groups from features groups.
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+ Genes per type = scoring genes detected (count > 0) in >= 1 % of the scored donors' observed
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+ cells of that type. Primary statistic `mean_cp10k`: per-cell CP10K over the scoring genes; per donor the mean over its
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+ cells of the type (donors with >= 1 such cell); group mean = mean over the group's donors (donor-balanced);
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+ logFC = log2(case mean + 1) - log2(control mean + 1). Secondary `pseudobulk_log1p_cpm`: the SLE benchmark evaluator's
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+ statistic (donor x type summed counts, log1p CPM over the scoring genes, mean case - mean control;
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+ evaluate_generated_vs_truth.group_log_fold_change). Both are computed on the generated cells (their frozen labels) and on
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+ the observed cells; `r_generated` = Pearson r of the two logFC vectors. Broadcast baseline `r_broadcast`: the same
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+ observed vector against the logFC of the input bulk (condition NPZ `bulk_counts` of the arm, scoring genes, per-donor
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+ CP10K resp. log1p CPM, group means). `partial_r_generated_given_broadcast`: r of the OLS residuals of observed and
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+ generated logFC on the bulk logFC (residual_specificity.py).
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+ 6. **Top-50 DEG overlap** (contrast.csv rows `statistic = welch_top50_deg`; summary `deg_top50`): the SLE benchmark's score (`total_top50_overlap` of
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+ `bulk2sc-paper/scripts/evaluate_generated_vs_truth.py`, Welch backend: the "top-50 DEG 81 / 84" of the final model), run
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+ with the evaluator's own functions on the same donor x type pseudobulks as the contrast. Per cell type, observed and
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+ generated separately: donor x type summed counts on all 5752 scoring genes (donors of the two groups with
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+ >= 1 cell of the type) -> `welch_bh_deg` (log1p CPM, two-sided Welch t-test case vs control, Benjamini-Hochberg over the
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+ genes with a defined p-value; needs >= 2 donors per group) -> `top_deg_genes` (FDR < 0.05, descending |logFC|,
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+ first 50; shorter when fewer genes pass). `top50_overlap` = |observed list & generated list|; `top50_jaccard`
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+ the evaluator's Jaccard. Summary `sum` = total over the scored types (the quantity reported as 81), `max` = the sum of
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+ the observed list lengths (the "of 262"), `sum_4type` = T + B + Monocyte + NK. A type is scored when its observed test
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+ is defined; an arm whose generated test is undefined for a scored type gets overlap 0. Types: T cell, B cell, Monocyte, NK cell, DC
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+ (aggregates: /home/sj_server_1/PBISC/immun-pbmc-fm/model_8_sparse_data_diffusion/plans/paired_finetune_intradataset_20260927/scoring_cache/ji2025_chili/deg_reference.npz).
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+ **Broadcast analogue** (`top50_overlap_broadcast`, as `sle_broadcast.py` `broadcast_input_bulk`; not part of the
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+ published benchmark): the same test on the arm's condition bulk_counts (scoring genes, the 16 + 10
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+ donors), one whole-PBMC top-50 list, compared with every type's observed list.
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+
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+ ## Files
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+ - `per_donor.csv`: one row per arm x donor (all per-donor quantities above).
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+ - `summary.json`: per arm the donor means / pooled values, provenance (NPZ sha, receipt check, generation metadata,
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+ Poisson nnz of the whole NPZ, annotation contract), and the reference block (PCA, R2 control).
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+ - `contrast.csv`: per arm x cell type x statistic (`mean_cp10k`, `pseudobulk_log1p_cpm`: logFC r; `welch_top50_deg`:
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+ top-50 DEG overlap, T / B / Monocyte / NK / DC; columns of the other kind are empty).
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+ - `arms/<arm>/labels/` (predict_scanvi.py labels + manifest), `arms/<arm>/generated_cells.parquet` (NPZ row, donor, label,
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+ UMI on the scoring genes, P/C subsample flag), `arms/<arm>/deg_top50_lists.csv` (observed, generated and broadcast
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+ top-50 gene lists, Ensembl ids, rank order).
paper-releases/pbisc-diffusion/updates/20260930T065633Z-summary-deck-scsemi-final/diffusion/dataset/server_1/model8/plans/paired_finetune_intradataset_20260927/scores/ji2025_chili/fewshot_n5/draw2_scsemi5/contrast.csv ADDED
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+ arm,celltype,statistic,n_genes,r_generated,r_broadcast,partial_r_generated_given_broadcast,r_generated_vs_broadcast,n_case_donors_obs,n_control_donors_obs,n_case_donors_gen,n_control_donors_gen,n_cells_obs,n_cells_gen,deg_scored,top50_overlap,top50_jaccard,obs_top_list_size,gen_top_list_size,n_sig_obs,n_sig_gen,top50_overlap_broadcast,top50_jaccard_broadcast,broadcast_top_list_size,n_sig_broadcast
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+ scsemi5,T cell,mean_cp10k,3072,0.2098165747465703,0.2701865645650968,0.12622048291840757,0.35629362939716336,16,10,16,10,42751,21936,,,,,,,,,,,
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+ scsemi5,T cell,pseudobulk_log1p_cpm,3072,0.10685974295234307,0.29511657864157254,0.054508510436193425,0.1887916056253993,16,10,16,10,42751,21936,,,,,,,,,,,
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+ scsemi5,B cell,mean_cp10k,3277,0.18457534118803495,0.15572870002588607,0.14460913208606,0.3145193191198802,16,10,14,9,5672,688,,,,,,,,,,,
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+ scsemi5,B cell,pseudobulk_log1p_cpm,3277,-0.014817159195365519,0.06708509712458424,-0.023863605332527807,0.13099082120335118,16,10,14,9,5672,688,,,,,,,,,,,
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+ scsemi5,Monocyte,mean_cp10k,3152,0.18892332636666287,0.37567927431475395,0.058071878919912126,0.369783409371101,16,10,16,9,28874,8190,,,,,,,,,,,
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+ scsemi5,Monocyte,pseudobulk_log1p_cpm,3152,0.0882137599243738,0.33780407869585316,0.023774710288588918,0.19618312707273142,16,10,16,9,28874,8190,,,,,,,,,,,
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+ scsemi5,NK cell,mean_cp10k,3069,0.14299134222648124,0.2533010131298753,0.06018363378366271,0.3491259174809879,16,10,16,9,14784,5511,,,,,,,,,,,
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+ scsemi5,NK cell,pseudobulk_log1p_cpm,3069,0.0959622271335853,0.1357496033139099,0.06976488289472567,0.20898288022567643,16,10,16,9,14784,5511,,,,,,,,,,,
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+ scsemi5,T cell,welch_top50_deg,5752,,,,,16,10,16,10,42751,21936,True,0,0.0,50,0,2050,0,4,0.05714285714285714,24,24
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+ scsemi5,B cell,welch_top50_deg,5752,,,,,16,10,14,9,5672,688,True,0,0.0,50,0,94,0,1,0.0136986301369863,24,24
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+ scsemi5,Monocyte,welch_top50_deg,5752,,,,,16,10,16,9,28874,8190,True,0,0.0,50,0,266,0,0,0.0,24,24
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+ scsemi5,NK cell,welch_top50_deg,5752,,,,,16,10,16,9,14784,5511,True,0,0.0,50,0,397,0,0,0.0,24,24
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+ scsemi5,DC,welch_top50_deg,5752,,,,,14,10,14,9,1112,1223,True,0,0.0,50,0,58,0,0,0.0,24,24
paper-releases/pbisc-diffusion/updates/20260930T065633Z-summary-deck-scsemi-final/diffusion/dataset/server_1/model8/plans/paired_finetune_intradataset_20260927/scores/ji2025_chili/fewshot_n5/draw2_scsemi5/per_donor.csv ADDED
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+ arm,donor,group,n_generated_cells,n_observed_cells,n_reference_cells,gen_T cell,obs_T cell,gen_B cell,obs_B cell,gen_Monocyte,obs_Monocyte,gen_NK cell,obs_NK cell,gen_DC,obs_DC,gen_Other,obs_Other,comp_l1,comp_l1_obs_loo_null,pb_r,pb_own_rank,pb_top1,precision,coverage,precision_depth_matched,coverage_depth_matched,mono_pct_gen,mono_pct_obs,median_umi_gen,median_umi_obs
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+ scsemi5,N064_TOL,TOL,1500,2498,150,0.8053333333333333,0.6517213771016813,0.016666666666666666,0.044035228182546036,0.078,0.1677341873498799,0.08533333333333333,0.07606084867894315,0.011333333333333334,0.010008006405124099,0.0033333333333333335,0.05044035228182546,0.32841953562850285,0.44066885632062114,0.5938115902129082,24,False,0.94,0.24,0.25333333333333335,0.11333333333333333,7.8,16.77341873498799,854.0,662.0
3
+ scsemi5,N064_FU1,FU1,1500,4659,150,0.82,0.6396222365314446,0.015333333333333332,0.016527151749302426,0.07466666666666667,0.13865636402661516,0.07666666666666666,0.19167203262502683,0.012,0.00472204335694355,0.0013333333333333333,0.008800171710667526,0.37531144022322377,0.447147467447507,0.5964374367802698,16,False,0.9333333333333333,0.04,0.31333333333333335,0.02,7.466666666666668,13.865636402661515,852.0,925.0
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+ scsemi5,N038_BC,BC,1500,2801,150,0.36,0.5608711174580507,0.020666666666666667,0.0046411995715815784,0.2813333333333333,0.16565512317029632,0.27066666666666667,0.2170653338093538,0.050666666666666665,0.034273473759371655,0.016666666666666666,0.017493752231345947,0.40339640604546,0.3913209350209281,0.5875578814809749,10,False,0.98,0.07333333333333333,0.4266666666666667,0.20666666666666667,28.133333333333333,16.565512317029633,854.0,1317.0
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+ scsemi5,N038_AC,AC,1500,3976,150,0.488,0.6830985915492958,0.014666666666666666,0.00829979879275654,0.31466666666666665,0.1290241448692153,0.14066666666666666,0.12072434607645875,0.012,0.03194164989939638,0.03,0.026911468812877263,0.43008048289738426,0.5093694384341356,0.5669785845886196,5,False,0.9533333333333334,0.23333333333333334,0.5,0.19333333333333333,31.466666666666665,12.90241448692153,855.0,910.5
6
+ scsemi5,N055_AC,AC,1500,4308,150,0.6926666666666667,0.340297121634169,0.05533333333333333,0.07799442896935933,0.11666666666666667,0.32474466109563604,0.09866666666666667,0.2051996285979573,0.006,0.0060352831940575676,0.030666666666666665,0.0457288765088208,0.7047390900649952,0.2683259872552967,0.6325476593459649,4,False,0.82,0.1,0.36,0.23333333333333334,11.666666666666666,32.47446610956361,852.5,1139.5
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+ scsemi5,N136_TOL,TOL,1500,759,150,0.8766666666666667,0.48616600790513836,0.005333333333333333,0.10013175230566534,0.08066666666666666,0.19104084321475626,0.010666666666666666,0.0922266139657444,0.014666666666666666,0.0013175230566534915,0.012,0.12911725955204217,0.807699604743083,0.3440190413647225,0.4548222265932968,10,False,0.8333333333333334,0.02666666666666667,0.34,0.07333333333333333,8.066666666666666,19.104084321475625,853.0,1837.0
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+ scsemi5,N136_FU1,FU1,1500,2927,150,0.8633333333333333,0.4246668944311582,0.0,0.14724974376494704,0.07866666666666666,0.19337205329689103,0.0013333333333333333,0.09531943969935087,0.0,0.0023915271609156134,0.056666666666666664,0.13700034164673727,0.8773328778043503,0.410613532351375,0.4442168426946195,3,False,0.8533333333333334,0.08,0.5933333333333334,0.17333333333333334,7.866666666666666,19.3372053296891,854.0,1501.0
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+ scsemi5,N138_TOL,TOL,1500,5129,150,0.3446666666666667,0.13803860401637746,0.022,0.02807564827451745,0.29333333333333333,0.5878338857477091,0.252,0.17703255995320724,0.05466666666666667,0.006044063170208618,0.03333333333333333,0.06297523883798012,0.6604362123870801,0.7733211231673002,0.5672929179844587,2,False,0.62,0.19333333333333333,0.62,0.09333333333333334,29.333333333333332,58.78338857477091,854.5,1117.0
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+ scsemi5,N138_FU1,FU1,1500,2107,150,0.724,0.2728998576174656,0.05533333333333333,0.04841006169909824,0.09866666666666667,0.4831514000949217,0.092,0.1134314190792596,0.016,0.005220692928334125,0.014,0.07688656858092074,0.9376054421768707,0.5540453704150132,0.5883074953949926,10,False,0.5733333333333334,0.11333333333333333,0.2733333333333333,0.21333333333333335,9.866666666666667,48.31514000949217,854.0,1446.0
11
+ scsemi5,N128_BC,BC,1500,3902,150,0.36533333333333334,0.5158892875448488,0.019333333333333334,0.06817016914402871,0.2773333333333333,0.29420809841107126,0.174,0.07842132239876987,0.044,0.03331624807790876,0.12,0.00999487442337263,0.43253511019989743,0.22126235566025862,0.5502653961968691,4,False,0.9133333333333333,0.24,0.37333333333333335,0.16,27.73333333333333,29.420809841107125,854.0,1088.0
12
+ scsemi5,N128_AC,AC,1500,2713,150,0.3586666666666667,0.5488389237007003,0.028666666666666667,0.06524143015112421,0.2886666666666667,0.2790269074824917,0.20933333333333334,0.07077036490969407,0.059333333333333335,0.029487652045705862,0.05533333333333333,0.006634721710283818,0.45349404103698243,0.24328457606458784,0.5388630503446206,13,False,0.9333333333333333,0.15333333333333332,0.4066666666666667,0.14666666666666667,28.866666666666667,27.90269074824917,853.0,1181.0
13
+ scsemi5,N129_BC,BC,1500,3087,150,0.464,0.5963718820861678,0.0013333333333333333,0.11305474570780694,0.3,0.08357628765792031,0.11066666666666666,0.18140589569160998,0.034666666666666665,0.013281503077421444,0.08933333333333333,0.012309685779073534,0.6296650469711694,0.4599645175272137,0.48724308468122546,4,False,0.5666666666666667,0.22666666666666666,0.38,0.12,30.0,8.35762876579203,854.0,1059.0
14
+ scsemi5,N129_AC,AC,1500,2798,150,0.37333333333333335,0.7076483202287348,0.02266666666666667,0.04932094353109364,0.2693333333333333,0.07969978556111508,0.238,0.13366690493209435,0.06866666666666667,0.0228734810578985,0.028,0.006790564689063617,0.7219385275196569,0.5428317542586936,0.5462854814053026,8,False,0.92,0.3333333333333333,0.44,0.23333333333333334,26.93333333333333,7.969978556111508,854.0,759.0
15
+ scsemi5,N150_BC,BC,1500,2433,150,0.43533333333333335,0.802301685162351,0.010666666666666666,0.02301685162351007,0.312,0.1385121249486231,0.19,0.02178380600082203,0.014,0.005754212905877518,0.038,0.008631319358816275,0.7586370735717222,0.7041534876493698,0.5858909641734336,4,False,0.98,0.02666666666666667,0.5333333333333333,0.26,31.2,13.851212494862311,854.0,1629.0
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+ scsemi5,N158_AC,AC,1500,3749,150,0.4726666666666667,0.24619898639637236,0.0006666666666666666,0.026673779674579887,0.38666666666666666,0.6295012003200854,0.05266666666666667,0.04934649239797279,0.014666666666666666,0.024806615097359295,0.07266666666666667,0.0234729261136303,0.5579631901840492,0.7651609044087362,0.5060027691900216,9,False,0.8133333333333334,0.17333333333333334,0.7,0.11333333333333333,38.666666666666664,62.95012003200854,855.0,1047.0
17
+ scsemi5,N159_BC,BC,1500,3779,150,0.98,0.6996559936491136,0.0,0.018523418893887273,0.0,0.08123842286319131,0.0,0.173590897062715,0.0,0.014024874305371792,0.02,0.01296639322572109,0.5747552262503307,0.5299123518003033,0.3854558071169306,1,True,0.04666666666666667,0.14,1.0,0.43333333333333335,0.0,8.123842286319132,855.0,1045.0
18
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