--- license: cc-by-4.0 tags: - single-cell - flow-cytometry - spectral-flow-cytometry - haematopoiesis - experimental-design size_categories: - 10M - **Wet-lab experiments and measurements:** Göttgens Lab - **License:** CC-BY-4.0 ## ⚠️ These files are per-loop, not cumulative `loops/loop3.h5ad` contains **only the cells measured in loop 3** — not loops 0–3 together. Models in the paper are trained on the *accumulated* data, so a loop's training set is the concatenation of every loop up to and including it: ``` dataset(N) = concat(dataset(N-1), loopN) ``` Concatenating them yourself is a few lines of `anndata`, but the exact chain matters (one loop introduces new protocol axes that must be zero-filled on the earlier data — see below). The reproduction repository ships a script that does it correctly: ```bash git clone https://github.com/theislab/LabCompass.git python scripts/data/build_loop_datasets.py # downloads from this repo and builds the chain python scripts/data/build_loop_datasets.py --variants 500k # subsampled only: far smaller and faster ``` ## Files Every loop is published in two variants: the full measurement set, and a subsampled version (`_500k` suffix) intended for fast iteration. The suffix is a naming convention carried over from the source data, not a guaranteed cell count — the subsampled files vary in size. | Loop | Full | Subsampled | Approx. size (full) | | --- | --- | --- | --- | | 0 (baseline) | `loops/loop0.h5ad` | `loops/loop0_500k.h5ad` | 36 GB | | 1 | `loops/loop1.h5ad` | `loops/loop1_500k.h5ad` | 2.5 GB | | 2 | `loops/loop2.h5ad` | `loops/loop2_500k.h5ad` | 3.9 GB | | 2.5 | `loops/loop2p5.h5ad` | `loops/loop2p5_500k.h5ad` | 2.7 GB | | 3 | `loops/loop3.h5ad` | `loops/loop3_500k.h5ad` | 6.3 GB | | 4 | `loops/loop4.h5ad` | `loops/loop4_500k.h5ad` | 0.9 GB | | 4.5 | `loops/loop4p5.h5ad` | `loops/loop4p5_500k.h5ad` | 0.5 GB | | 5 | `loops/loop5.h5ad` | `loops/loop5_500k.h5ad` | 6.3 GB | Loop 0 is the baseline screen and is by far the largest. The half-steps (2.5, 4.5) are follow-up rounds within a design cycle and accumulate like any other loop, giving the chain ``` loop0 → loop1 → loop2 → loop2p5 → loop3 → loop4 → loop4p5 → loop5 ``` The full set is roughly 60 GB; the subsampled set is a few GB. ## Format Each file is an [AnnData](https://anndata.readthedocs.io/) `.h5ad` object: - **`X`** — logicle-transformed SFC intensities: fluorescence channels and morphological scatter features, one row per cell. - **`obs`** — per-cell metadata, in three groups: - *Acquisition:* `experiment_number`, `experiment_id`, `replicate`, `date`, `well_id`, `cytometer`, `cytometer_serial_no`, `count_beads`, `cell_counts`, `source_id`. - *Protocol axes* — the culture recipe, and the space LabCompass searches over. Cytokines and small molecules carry their units in the column name, e.g. `scf_[ng_ml]`, `tpo_[ng_ml]`, `il3_[ng_ml]`, `gm-csf_[ng_ml]`, `rhflt3l_[ng_ml]`, `ldl_[ng_ml]`, `sr1_[nm]`, `um171_[nm]`, `um729_[µm]`, `butyzamide_[nm]`, `retinoic_acid_[µm]`, `mtg_[µm]`, `740-yp_[µm]`, alongside culture conditions such as `o2_[%]` and `hydrogel_type`. - *Annotation:* cell-type labels, where available. `experiment_number` identifies the physical experiment a cell came from (loop 1, for instance, spans experiments 206–210), which makes it a convenient way to check which loops are present in a concatenated object. ### The protocol schema grows across loops Later loops vary axes that earlier loops never did. Loop 3 introduces `il7_[ng_ml]`, `mcsf_[ng_ml]` and `ly_cocktail_[ul/well]`, which are absent from loops 0–2.5. When concatenating, these must be **zero-filled on the earlier data** (they were held at zero, not missing) so both sides share an `obs` schema. `build_loop_datasets.py` does this; a naive `anndata.concat` will silently drop the columns instead. ## Loading ```python import anndata as ad from huggingface_hub import hf_hub_download path = hf_hub_download( repo_id="theislab/LabCompass", filename="loops/loop3_500k.h5ad", repo_type="dataset", ) adata = ad.read_h5ad(path) ``` ## Citation ```bibtex @article{labcompass, title = {TODO}, author = {Consoli, Lorenzo and Palma, Alessandro and others}, journal = {TODO}, year = {TODO}, } ```