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paper-releases/pbisc-diffusion/updates/20260928T225702Z-paired-ft-scsemi-delta/diffusion/dataset/server_1/model8/plans/paired_finetune_intradataset_20260927/scores/imperial_eskd/fewshot_n5/draw2_scsemi5/contrast.csv ADDED
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1
+ 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
2
+ scsemi5,T cell,mean_cp10k,3036,0.6303084207739375,0.6311553277299028,0.575486171136399,0.33137624044505765,103,31,103,31,249798,101244,,,,,,,,,,,
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+ scsemi5,T cell,pseudobulk_log1p_cpm,3036,0.356856949420089,0.6350373450250355,0.2713132079444818,0.24169651651795887,103,31,103,31,249798,101244,,,,,,,,,,,
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+ scsemi5,B cell,mean_cp10k,3187,0.49036614830717173,0.6245632309702648,0.394073194357464,0.317941843970975,103,31,102,31,46668,10503,,,,,,,,,,,
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+ scsemi5,B cell,pseudobulk_log1p_cpm,3187,0.025478153221376126,0.4816610289030315,-0.08059674919730155,0.1966740332907685,103,31,102,31,46668,10503,,,,,,,,,,,
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+ scsemi5,Monocyte,mean_cp10k,2886,0.6047453753942459,0.6837051334204964,0.36554231497527695,0.5617173759440347,102,31,102,31,75478,39857,,,,,,,,,,,
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+ scsemi5,Monocyte,pseudobulk_log1p_cpm,2886,0.39128867943202456,0.6802082395314715,0.1594600320663849,0.41923862429931846,102,31,102,31,75478,39857,,,,,,,,,,,
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+ scsemi5,NK cell,mean_cp10k,2961,0.5241242811116497,0.6340215947478178,0.38874369486241706,0.3900772667930024,103,31,102,31,66389,36488,,,,,,,,,,,
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+ scsemi5,NK cell,pseudobulk_log1p_cpm,2961,0.2637650789441471,0.5753918871563406,0.14475695448330875,0.25970820176082243,103,31,102,31,66389,36488,,,,,,,,,,,
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+ scsemi5,T cell,welch_top50_deg,5927,,,,,103,31,103,31,249798,101244,True,12,0.13636363636363635,50,50,655,1166,13,0.14942528735632185,50,2026
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+ scsemi5,B cell,welch_top50_deg,5927,,,,,103,31,102,31,46668,10503,True,5,0.05263157894736842,50,50,240,680,10,0.1111111111111111,50,2026
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+ scsemi5,Monocyte,welch_top50_deg,5927,,,,,102,31,102,31,75478,39857,True,7,0.07526881720430108,50,50,235,537,18,0.21951219512195122,50,2026
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+ scsemi5,NK cell,welch_top50_deg,5927,,,,,103,31,102,31,66389,36488,True,8,0.08695652173913043,50,50,359,411,13,0.14942528735632185,50,2026
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+ scsemi5,DC,welch_top50_deg,5927,,,,,103,31,101,31,12425,9224,True,8,0.08695652173913043,50,50,214,394,11,0.12359550561797752,50,2026
paper-releases/pbisc-diffusion/updates/20260928T225702Z-paired-ft-scsemi-delta/diffusion/dataset/server_1/model8/plans/paired_finetune_intradataset_20260927/scores/imperial_eskd/fewshot_n5/draw2_scsemi5/per_donor.csv ADDED
@@ -0,0 +1,143 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ 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,C20_1004,covid_positive,1500,1810,150,0.148,0.43425414364640885,0.048,0.3994475138121547,0.21066666666666667,0.03867403314917127,0.5266666666666666,0.07790055248618785,0.056,0.04751381215469613,0.010666666666666666,0.0022099447513812156,1.275403314917127,0.5974866812416445,0.5893827952717616,115,False,0.18666666666666668,0.013333333333333334,0.21333333333333335,0.08,21.066666666666666,3.867403314917127,1014.0,1373.5
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+ scsemi5,C31_2704,covid_positive,1500,4200,150,0.8866666666666667,0.7042857142857143,0.023333333333333334,0.08023809523809523,0.04533333333333334,0.08714285714285715,0.028666666666666667,0.09857142857142857,0.014,0.025952380952380952,0.002,0.0038095238095238095,0.3647619047619048,0.40040928921696595,0.644706169941503,9,False,0.16666666666666666,0.013333333333333334,0.6133333333333333,0.2,4.533333333333333,8.714285714285715,1013.0,1704.0
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+ scsemi5,C33_1401,covid_positive,1500,3983,150,0.6533333333333333,0.38890283705749434,0.019333333333333334,0.016570424303288978,0.14533333333333334,0.11172483052975145,0.14733333333333334,0.464474014561888,0.006666666666666667,0.014310820989204118,0.028,0.004017072558373086,0.6495696711021842,0.614673424247788,0.6767767346840986,34,False,0.30666666666666664,0.14,0.08666666666666667,0.09333333333333334,14.533333333333335,11.172483052975144,1012.0,909.0
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+ scsemi5,C33_1601,covid_positive,1500,395,150,0.21666666666666667,0.14430379746835442,0.04,0.11645569620253164,0.492,0.2,0.16466666666666666,0.5240506329113924,0.06133333333333333,0.007594936708860759,0.025333333333333333,0.007594936708860759,0.8716793248945147,0.8089588985894992,0.7278628860395535,57,False,0.42,0.14666666666666667,0.30666666666666664,0.22,49.2,20.0,1015.0,644.0
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+ scsemi5,C33_1901,covid_positive,1500,1947,150,0.26866666666666666,0.3754494093477144,0.034,0.042116076014381096,0.47533333333333333,0.12223934257832562,0.10533333333333333,0.43656908063687727,0.092,0.01078582434514638,0.024666666666666667,0.012840267077555213,0.8922691319979457,0.5588635563977664,0.7537742855492338,2,False,0.26,0.12,0.16666666666666666,0.22,47.53333333333333,12.223934257832562,1011.0,897.0
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+ scsemi5,C34_1404,covid_positive,1500,2483,150,0.30933333333333335,0.8771647200966572,0.016,0.01973419250906162,0.25533333333333336,0.016915022150624244,0.36,0.07047925896093435,0.048666666666666664,0.011679420056383408,0.010666666666666666,0.004027386226339106,1.143131158544771,0.7472831727062155,0.6100849147808382,114,False,0.47333333333333333,0.013333333333333334,0.43333333333333335,0.06,25.533333333333335,1.6915022150624244,1014.0,1720.0
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+ scsemi5,C34_2104,covid_positive,1500,2808,150,0.35733333333333334,0.7916666666666666,0.016,0.024216524216524215,0.23733333333333334,0.041666666666666664,0.3273333333333333,0.12428774928774929,0.048666666666666664,0.013888888888888888,0.013333333333333334,0.004273504273504274,0.8850997150997151,0.5762870658462342,0.6427044217930669,53,False,0.38666666666666666,0.013333333333333334,0.38666666666666666,0.32,23.733333333333334,4.166666666666666,1012.0,2067.5
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+ scsemi5,C34_2504,covid_positive,1500,1945,150,0.36466666666666664,0.6961439588688946,0.012,0.024678663239074552,0.23466666666666666,0.12544987146529563,0.31866666666666665,0.12904884318766066,0.059333333333333335,0.02416452442159383,0.010666666666666666,0.0005141388174807198,0.688311910882605,0.3852416502506901,0.6464374374373708,19,False,0.42,0.0,0.3466666666666667,0.2733333333333333,23.466666666666665,12.544987146529563,1012.0,2111.0
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+ scsemi5,C36_1504,covid_positive,1500,4765,150,0.526,0.7643231899265478,0.20133333333333334,0.14144805876180483,0.20466666666666666,0.03546694648478489,0.022,0.030640083945435468,0.037333333333333336,0.01951731374606506,0.008666666666666666,0.008604407135362015,0.4939265477439665,0.5577691809547796,0.6587813369628784,55,False,0.4266666666666667,0.02,0.4866666666666667,0.31333333333333335,20.466666666666665,3.546694648478489,1013.0,1747.0
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+ scsemi5,C36_1704,covid_positive,1500,1554,150,0.5333333333333333,0.842985842985843,0.198,0.07335907335907337,0.192,0.014800514800514801,0.014666666666666666,0.0546975546975547,0.051333333333333335,0.010296010296010296,0.010666666666666666,0.003861003861003861,0.6993667953667954,0.6790734686771788,0.6356310102624827,39,False,0.43333333333333335,0.006666666666666667,0.4533333333333333,0.30666666666666664,19.2,1.4800514800514801,1013.0,2044.5
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+ scsemi5,C40_1504,covid_positive,1500,5482,150,0.25466666666666665,0.7433418460415907,0.03933333333333333,0.09649762860269974,0.20666666666666667,0.05600145932141554,0.43733333333333335,0.09157241882524626,0.05266666666666667,0.009668004377964246,0.009333333333333334,0.002918642831083546,1.0916789492885808,0.4724082245171275,0.614783998316073,7,False,0.18,0.006666666666666667,0.14,0.23333333333333334,20.666666666666668,5.6001459321415545,1013.0,1253.5
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+ scsemi5,C58_2901,covid_positive,1500,1615,150,0.45666666666666667,0.6179566563467492,0.0006666666666666666,0.03653250773993808,0.22733333333333333,0.17956656346749225,0.24,0.10835913312693499,0.05733333333333333,0.03219814241486068,0.018,0.025386996904024767,0.4090856553147575,0.2938991131717485,0.536319242081303,37,False,0.5266666666666666,0.16,0.56,0.22,22.733333333333334,17.956656346749224,1014.0,882.0
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+ scsemi5,C58_0102,covid_positive,1500,972,150,0.332,0.5339506172839507,0.018666666666666668,0.027777777777777776,0.238,0.2880658436213992,0.342,0.11316872427983539,0.058,0.03292181069958848,0.011333333333333334,0.00411522633744856,0.522255144032922,0.3201349008797254,0.6085667606412063,81,False,0.44666666666666666,0.10666666666666667,0.3333333333333333,0.07333333333333333,23.799999999999997,28.80658436213992,1012.0,749.0
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104
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107
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108
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paper-releases/pbisc-diffusion/updates/20260928T225702Z-paired-ft-scsemi-delta/diffusion/dataset/server_1/model8/plans/paired_finetune_intradataset_20260927/scores/imperial_eskd/fewshot_n5/draw3_scsemi5/README.md ADDED
@@ -0,0 +1,73 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ # score_ft.py output: imperial_eskd, 145 scored donors
2
+
3
+ Arms: scsemi5. Every arm is scored on the same donors against the same observed reference.
4
+
5
+ ## Inputs and fixed contracts
6
+ - Observed reference: `/home/sj_server_1/PBISC/immun-pbmc-fm/model_8_sparse_data_diffusion/plans/paired_finetune_intradataset_20260927/scoring_cache/imperial_eskd/reference.npz` (sha 34b4caa3f8a6), built from datadir:/home/sj_server_1/PBISC/immun-pbmc-fm/model_8_sparse_data_diffusion/plans/paired_finetune_intradataset_20260927/data/imperial_eskd;
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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/imperial_eskd/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 (1005 genes).
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+ - Scoring genes: 6k panel genes measured by both assays in every sample of the dataset (5927 genes).
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+
15
+ ## 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 145 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) (21682 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 0.9691, coverage 0.9998.
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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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+ 0.9693, coverage 0.9997.
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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 ['covid_positive'] (n = 104) vs control groups ['covid_negative'] (n = 31); 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 5927 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/imperial_eskd/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 104 + 31
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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).