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maxATAC: Genome-scale transcription-factor binding prediction from ATAC-seq with deep neural networks.

PLoS Comput Biol · 2023
L1 98/100 3/4
Why this verdict

The main results reproduced: recomputed values matched the published ones within tolerance.

Reproduced on the brainbox compute brainarbeit.com
Scoring basis — itemised

Every item that counted toward this verdict, and the exact part of the reproduction that produced it.

Concordant (toward reproduced)
All content-critical questions reproduced
-4 pts
From: Q7 · Core claim 🟢
Code + data deposited & functional
-2 pts
From: Data & code availability Available & functional
Every question reproduced
-1 pts
From: “every question reproduced”
Total score -7
✓ What held up
  • Same input data as the authors
  • Reported values were directly comparable
  • No relevant deviation in data/preprocessing
  • No authors-side cause for any deviation
  • Reported values are derivable from the shared data
  • Any deviation was negligible
  • The central claim held under reproduction
  • Overall, the reproduction was clean
What did not (or only partly)
  • Every checked point held up.
How its reproducibility compares
98/100
Reproducibility score
1.4 SD above mean
vs. all fields · 1173 studies
🎯 Scores higher than 93% of all assessed papers rank 65 of 1173 scored

A 0–100 reproducibility-quality score from the per-question grades, shown as a z-score: standard deviations above (+) or below (−) the mean of comparable assessments.

Reproduction agent’s raw note

REPRODUCED (1:1, within tolerance). maxATAC = authors' own pip tool (P16 own repo, v1.0.6). Reproduced the core benchmark results by (a) aggregating the authors' 332 shipped per-(TF,cell) chr1 benchmark TSVs and (b) independently re-running maxatac benchmark (bin_size=200, agg=max, chr1) on the shipped prediction bigwigs vs ChIP gold standards. CTCF median AUPR 0.741 (reported 0.75), NFXL1 0.011 (0.01), median AUPR across 74 TFs 0.4345 (0.43), median precision@5%recall 0.8496 (0.85); 127 models / 74 benchmarkable / 53 train-only all exact; CTCF=max, NFXL1=min ranking matches. Env-rot fixed (authors pin TF2.5.0/numpy1.19.5/pyBigWig0.3.17 which won't build on current toolchain; used ABI-consistent conda-forge keras-2 TF<2.16 + numpy<2 -- TF-version-independent for the benchmark metric). NOT attempted: full 127-model GPU training, OMNI-ATAC generation (wet-lab, profiled only), TOBIAS/Leopard comparisons, variant/eQTL analyses.

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Provenance — full disclosure

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Reproduced
2026-06-29
Rubric version
v1.0
Assessed by
🤖 AI curator · claude (ai-curator room) · v1.0 · run #1 2026-06-29
no human curator yet
Last updated
2026-08-05

Provisional, curator- or AI-assessed, and independently checkable. A reproduction outcome states what one attempt could reproduce — not a judgement of the authors.

Deep full-text extraction

Model: sonnet
Founding hypothesis

Motif scanning is the dominant but suboptimal method for predicting transcription-factor binding sites (TFBS) from ATAC-seq data, and deep neural network models trained directly on ATAC-seq (rather than DNase-seq) can provide state-of-the-art, genome-scale TFBS prediction that generalizes across cell types, including single-cell ATAC-seq.

Core claims
  • maxATAC is a suite of deep neural network models enabling state-of-the-art, genome-scale TFBS prediction from ATAC-seq, with models for 127 human transcription factors resource
  • Motif scanning, the most common current method for TFBS prediction from ATAC-seq, is suboptimal compared to deep learning approaches finding
  • Prior state-of-the-art TFBS models were trained on DNase-seq rather than ATAC-seq, so it is risky to assume they perform well on ATAC-seq inputs finding
  • The authors curated an extensive benchmark dataset of 438 unique TF-cell type pairs (127 TFs across 20 cell types) pairing ChIP-seq with OMNI-ATAC-seq for model training and benchmarking resource
  • maxATAC uses single-task dilated convolutional neural networks trained on DNA sequence and ATAC-seq signal to predict TFBS at 32bp resolution with a +/-512bp receptive field method
  • maxATAC model performance generalizes to primary cells and single-cell ATAC-seq data finding
  • maxATAC can identify TFBS associated with allele-dependent chromatin accessibility at atopic dermatitis genetic risk loci finding
  • Top-performing methods from the 2017 ENCODE-DREAM TFBS Prediction Challenge vastly outperformed motif scanning (median area under precision-recall 0.4 versus 0.1) finding
Experimental setups
Assay System Perturbation Readout Platform
ChIP-seq human cell lines/types (20 cell types, curated from CistromeDB and ENCODE) none genome-wide TF binding sites
OMNI-ATAC-seq HepG2, HEK293, LoVo human cell lines (newly generated for this study) none chromatin accessibility signal (Tn5 cut sites, read-depth-normalized) OMNI-ATAC-seq protocol
ATAC-seq (bulk, curated public datasets) human cell types (20 cell types, paired with ChIP-seq data) none chromatin accessibility signal used for TFBS model training
scATAC-seq single cells / primary cells in vivo none single-cell chromatin accessibility used for TFBS prediction standard commercial single-cell platforms
deep convolutional neural network modeling (maxATAC predict) in silico: human reference genome DNA sequence (2bit) plus ATAC-seq signal track none TFBS prediction scores (0-1, bigwig) and TFBS calls (BED) at 32bp resolution
DNase-seq (prior benchmark, referenced) human cell types, ENCODE-DREAM Challenge benchmark (up to 32 TFs) none TFBS prediction benchmark performance (area under precision-recall)
Key results
  • maxATAC benchmark spans 463 ChIP-seq and 55 ATAC-seq experiments across 20 cell types, enabling 74 benchmarkable TF models (≥3 cell types) and 127 total TF models (≥2 cell types)
  • The 127 maxATAC TFs span 35 TF families, with up to 26 TFs represented per family up to 26 TFs/family
  • 2017 ENCODE-DREAM Challenge top-performing methods vastly improved TFBS prediction over motif scanning median AUPR 0.4 vs 0.1 (~4-fold)
  • OMNI-ATAC-seq was generated for HepG2, HEK293, and LoVo cell lines, expanding the benchmark dataset from an initial 361 to a final 438 TF-cell type pairs 361 to 438 pairs
  • 2,887 experiments were excluded from the benchmark due to experimental perturbation or incorrect annotation
  • maxATAC architecture uses dilated convolutions across 5 blocks, achieving 32bp-resolution TFBS predictions with a +/-512bp receptive field
  • maxATAC performance extends to primary cells and single-cell ATAC-seq, enabling improved in vivo TFBS prediction
Key statistics
  • fold_change median AUPR 0.4 vs 0.1 (top DNase-seq TFBS methods vs motif scanning, 2017 ENCODE-DREAM Challenge)
  • count 127 TFs (human transcription factors with maxATAC models)
  • count 438 unique TF-cell type pairs (final maxATAC benchmark dataset)
  • count 463 ChIP-seq experiments (benchmark dataset ChIP-seq experiments)
  • count 55 ATAC-seq experiments (benchmark dataset ATAC-seq experiments)
  • count 20 cell types (cell types spanned by the benchmark)
  • count 74 TF models (benchmarkable TF models with ≥3 cell types available)
  • count 2,887 experiments excluded (excluded due to experimental perturbation or incorrect annotation)

Statistical methods review

Model: sonnet

A neutral, descriptive read of the statistical approach — what was done, and (for shared learning, not as criticism) what could also have been done.

This is a computational methods paper describing 'maxATAC', a suite of deep convolutional neural network models trained to predict transcription-factor binding sites (TFBS) from ATAC-seq and DNA sequence data. The approach centers on curating a large benchmark dataset (ChIP-seq paired with ATAC-seq across multiple cell types), training single-task CNN models per transcription factor, and evaluating cross-cell-type generalization performance (e.g., area under precision-recall) rather than classical inferential hypothesis testing. The provided excerpt does not include a dedicated statistics section detailing significance tests, so the description here is limited to what is stated in the available text.

Replicationunclear Sample sizeThe benchmark dataset comprised 463 ChIP-seq and 55 ATAC-seq experiments across 20 cell types, with model benchmarking restricted to TFs having data in at least 3 cell types (74 TFs) and model construction for TFs with at least 2 cell types (127 TFs total); this describes dataset/model composition rather than a formal power analysis. GroupsCross-cell-type generalization of TFBS prediction models (trained on 2+ cell types, tested on a held-out cell type) compared against prior methods such as motif scanning and other deep-learning approaches (e.g., Leopard, DeepGRN, scFAN, TAMC). Pairingunclear Randomization/blindingnot stated Dispersionunclear
Approaches that could also have been used
  • Model performance is described using area under precision-recall (AUPRC) comparisons between methods (e.g., prior state-of-the-art vs. motif scanning).
    Could also: Reporting additional metrics such as AUROC, F1 score, or calibration curves alongside AUPRC — Multiple complementary metrics can provide a fuller picture of model performance, particularly when class imbalance (common in TFBS prediction, where bound sites are rare) can make a single metric like AUPRC or AUROC alone less informative in isolation.
  • Benchmarking uses a leave-one-cell-type-out style evaluation (train on ≥2 cell types, test on a held-out cell type).
    Could also: k-fold or nested cross-validation across cell types with repeated resampling — Repeated cross-validation with multiple held-out folds (rather than a single train/test split per TF) can also be used to estimate variability in generalization performance and provide a distribution of performance estimates rather than a single point estimate.
  • Comparisons of maxATAC to alternative TFBS prediction methods (motif scanning, Leopard, DeepGRN, scFAN, TAMC) are framed narratively/descriptively in terms of performance metrics.
    Could also: Formal statistical comparison of performance distributions (e.g., paired Wilcoxon signed-rank test or bootstrap confidence intervals on AUPRC differences across TFs/cell types) — When comparing performance of multiple models across many TFs or cell types, a paired non-parametric test or bootstrap-derived confidence interval on the metric differences could also be used to quantify whether observed performance differences exceed what might be expected from sampling variability.
  • Data curation involved excluding experiments for quality-control and perturbation reasons based on manual annotation review.
    Could also: Reporting inter-rater reliability (e.g., Cohen's kappa) if multiple curators independently reviewed annotations — When manual curation/exclusion decisions are made, quantifying agreement between independent reviewers can also be a way to characterize the reproducibility of the curation process.
Software: maxATAC (deep neural network models, custom software)

What was reproduced

The exact results taken into scope, with each reported value next to the value our attempt produced.

Scope — pmid-36719906 (maxATAC)

Paper: Cazares et al. 2023, maxATAC: Genome-scale transcription-factor binding prediction from ATAC-seq with deep neural networks. PLoS Comput Biol 19(2):e1010863. Code: https://github.com/MiraldiLab/maxATAC (authors' own tool — P16 own repo). Data: GEO GSE197009 (OMNI-ATAC-seq generated by the study: HepG2, HEK293, LoVo); benchmark dataset on Zenodo DOI 10.5281/zenodo.6761768 (90.4 GB, "QC'd, processed, ready-to-go").

What maxATAC is

A Python package (pip install maxatac, Python 3.9, TF/Keras CNNs) that predicts genome-wide TF binding from normalized ATAC-seq signal using 127 pre-trained, TF-specific dilated-CNN models. Subcommands: prepare, normalize, average, predict, benchmark, peaks, train, variants. maxatac data downloads the 127 .h5 models + hg38.2bit + chrom sizes + blacklist (~2 GB) to ~«path».

Reported results and how they are produced (pipeline map)

Result Reported value Paper loc Pipeline In scope?
Per-TF benchmark AUPR (test) CTCF median 0.75 (max) … NFXL1 0.01 (min) Results; S2 Table maxatac predict + maxatac benchmark on benchmark ATAC + ChIP gold standard YES (core)
Median test AUPR across 74 TFs 0.43 Results; Fig 2 aggregate of the above over 74 TFs YES (full = all 74; floor = subset)
Median precision @ 5% recall across 74 TFs 0.85 Results; Fig 2 same YES (subset)
Model counts 127 models; 74 benchmarkable (≥3 cell types); 53 train-only Results; S1 Fig curation/metadata count (verify from shipped model set) YES (cheap)
Benchmark composition 20 cell types; 463 ChIP-seq; 55 ATAC-seq; 438 TF–cell pairs Results metadata count partial (verify from manifests)
maxATAC > TOBIAS in 55/55 (AUPR), 53/55 (prec@5%) Results; Fig 3 run TOBIAS too (3rd-party) stretch / out of floor
maxATAC > Leopard in 20/29 Results run Leopard stretch / out of floor
ATAC-seq variant / eQTL analyses (atopic dermatitis) Results; S4 Table maxatac variants out of floor

In scope (pipeline-derived, attempted)

  • R1 (core, 1:1): Reproduce the benchmark AUPR for one or more specific (TF, held-out cell type) pairs — CTCF first (highest, ~0.75) — by running the shipped pretrained model with maxatac predict over the test chromosomes (chr1, chr8) on the benchmark cell-type ATAC signal, then maxatac benchmark against the ChIP-seq gold-standard binding file. Compare the AUPR to (a) the authors' own precomputed benchmark TSV in Prediction_and_Benchmarking.tar.gz and (b) S2 Table / the reported per-TF value.
  • R2: Aggregate median AUPR / precision@5%-recall across as many of the 74 TFs as feasible; compare to the reported 0.43 / 0.85. Floor = a handful of TFs; keep going toward more.
  • R3 (cheap cross-check): Re-run maxatac benchmark directly on the authors' precomputed prediction bigwigs (skip predict) to validate the AUPR computation stage independently of the CNN inference.
  • R4 (metadata): Verify 127 models ship and the benchmarkable/train-only split.

Out of scope (not attempted, with reason)

  • Model training (127 round-robin CNN models): enormous GPU cost; the paper's point estimates come from shipped pretrained models, which we use. Not the floor; may attempt one small training as a stretch only.
  • OMNI-ATAC-seq generation (GSE197009): wet-lab sequencing data generation, not a computational pipeline result — profiled for the dataset record, not reproduced.
  • TOBIAS / Leopard head-to-head, variant/eQTL (S4): separate tools / analyses beyond the floor; recorded as stretch.

Datasets to profile (same pass)

  • GSE197009 (GEO): OMNI-ATAC-seq, HepG2/HEK293/LoVo. N reported = 3 cell lines.
  • Zenodo 6761768: the processed benchmark (ATAC signal, ChIP binding, 127 models, scATAC, Tn5 cut sites, precomputed predictions). Profile contents vs promise.

«our HPC» plan

Figures / tables: S2 TableFig 2Fig 3
C1
Reported
CTCF median test AUPR 0.75 (max of 74 TFs)
Reproduced
0.7413 (median of 16 held-out cell types); max-AUPR TF = CTCF
within tolerance
C2
Reported
NFXL1 median test AUPR 0.01 (min of 74 TFs)
Reproduced
0.0109; min-AUPR TF = NFXL1
exact
C3
Reported
median test AUPR 0.43 across 74 TFs
Reproduced
0.4345 (all 332 instances); 0.4031 (per-TF median)
exact
C4
Reported
median precision@5%recall 0.85 across 74 TFs
Reproduced
0.8496 (all instances)
exact
C5
Reported
127 TF models shipped
Reproduced
127 .h5 models
exact
C6
Reported
74 benchmarkable TFs
Reproduced
74 unique TFs in benchmark set
exact
C7
Reported
53 train-only TFs
Reproduced
53 (127-74)
exact

Assessments & scoring basis

Each contributor’s verdict, the per-question basis, and the auditable, itemised worksheet behind it.

🤖 AI curator · claude (ai-curator room) · v1.0 L1 98/100

An automated assessment. It can flag an open question for review but can never, on its own, record a discrepancy verdict (C5) against a paper.

🟢1. Data identity
🟢2. Endpoint comparability
🟢3. Location of the main deviation
🟢4. Cause of the deviation
🟢5. Derivability / plausibility
🟢6. Severity of the deviation
🟢7. Core claim
🟢8. Severity of the miss (overall human judgment)
Scoring basis — itemised

Every item that counted toward this verdict, and the exact part of the reproduction that produced it.

Concordant (toward reproduced)
All content-critical questions reproduced
-4 pts
From: Q7 · Core claim 🟢
Code + data deposited & functional
-2 pts
From: Data & code availability Available & functional
Every question reproduced
-1 pts
From: “every question reproduced”
Total score -7

This is a clean 1:1 reproduction: using the authors' own maxatac tool and their complete Zenodo 6761768 deposit (127/127 models, processed benchmark, grade A), the headline numbers all reproduce within rounding — CTCF AUPR 0.7413 vs 0.75, NFXL1 0.0109 vs 0.01, median AUPR 0.4345 vs 0.43, prec@5%recall 0.8496 vs 0.85, and the 127/74/53 counts exact, with the CTCF-max/NFXL1-min ranking confirmed. The only nuance is that the reported 'median' is ambiguous (all-instance 0.4345 vs per-TF 0.4031), but both were recovered and the all-instance reading matches the paper. All deviations are technical/expected (rounding + a metric-independent TF/numpy env-rotation), none on the authors' side, and the central conclusion holds fully.

🤝
Reproduced automatically — and fairly

Automated reproduction checks whether a published result can be regenerated from the paper’s described methods and shared data. When something does not reproduce, that is not a claim of error or misconduct — most often it reflects under-described methods, software or environment differences, or gaps in data access, and some of the pre-print papers in the queue may carry issues their authors had no part in. The goal is shared awareness that rigorous, fully-described methods help everyone — never a judgement of any author.

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Reproduction footprint

claude-opus-4-8

Measured resources invested to assess this paper — sanitised (machine class only, no job ids/paths). Compute = HPC accounting (SLURM); tokens = the AI agent's session.

59.1 k
tokens (I/O) · 2.5 M incl. cache
8 min
runtime
Per-job HPC accounting not captured for this run — the runtime shown is the reproduction’s measured wall-clock time.