biocurator 0.1.0

A config-driven framework for curating biological sequence datasets from NCBI and UniProt

biocurator

A config-driven framework for curating biological sequence datasets from various databases. Define your search, filter, and export parameters in a YAML file; biocurator handles the rest.

Features

• Multi-database search — NCBI (nucleotide, protein, SRA) and UniProt
• Typed config schema — validated YAML with sensible defaults
• Flexible filtering — length, quality score, organism, keywords, date range
• Multiple export formats — FASTA, CSV, JSON
• Rich CLI — progress bars, dry-run mode, per-job filtering

Supported Databases

• NCBI
• UniProt

Installation

Requires Python 3.13+.

# With uv (recommended)
uv pip install biocurator

# With pip
pip install biocurator

Quick Start

1. Generate a config file

biocurator init --output config.yaml

This writes a starter YAML to config.yaml. Use --template advanced to include all optional fields:

biocurator init --template advanced --output config.yaml

2. Edit the config

email: [e-mail]

jobs:
  covid-genomes:
    search:
      databases: [ncbi]
      organism: "SARS-CoV-2"
      sequence_type: nucleotide
      keywords: ["complete genome"]
      max_results: 50
    filter:
      min_length: 29000
      quality_threshold: 0.8
    export:
      outdir: results/covid
      formats: [fasta, csv]
      prefix: sars_cov2

3. Run a dry-run to preview

biocurator run config.yaml --dry-run

Dry run — 1 job(s) would execute:
  • covid-genomes  databases=['ncbi']

4. Execute

biocurator run config.yaml

Config Reference

Every config file has a top-level email (required for NCBI access) and a jobs map where each key is the job name.

email: [e-mail] # required

jobs:
  <job-name>:
    search:
      databases: [ncbi] # required: ncbi | uniprot
      organism: null # e.g. "SARS-CoV-2", "E. coli"
      sequence_type: nucleotide # nucleotide | protein | sra
      keywords: [] # AND-joined with other terms
      max_results: 100
      exclude_terms: [] # excluded from search
      location: null # geographic filter, e.g. "Philippines"
      taxonomy_filter: null # taxon name or ID
      date_range:
        start: "2020/01/01" # YYYY/MM/DD
        end: "2024/12/31"
    filter:
      min_length: null # minimum sequence length (bp / aa)
      max_length: null # maximum sequence length (bp / aa)
      exclude_terms: [] # excluded from title/description
      quality_threshold: null # 0.0–1.0; filters on N/X content
    export:
      outdir: results # output directory (created if absent)
      formats: [fasta] # fasta | csv | json
      prefix: biocurator # filename prefix for output files

Defaults apply to any omitted field, so a minimal job only needs search.databases:

email: [e-mail]

jobs:
  simple:
    search:
      databases: [ncbi]
      organism: "Homo sapiens"
    filter: {}
    export: {}

CLI Reference

biocurator init

Generate a starter config file.

Usage: biocurator init [OPTIONS]

Options:
  -o, --output TEXT    Write config to this file instead of stdout
  -t, --template TEXT  Template to use: basic (default) or advanced

biocurator run

Run all jobs defined in a config file.

Usage: biocurator run [OPTIONS] CONFIG

Arguments:
  CONFIG  Path to the YAML config file  [required]

Options:
  -j, --jobs TEXT  Comma-separated job names to run (default: all)
  --dry-run        Validate config and preview jobs without downloading

Run only specific jobs:

biocurator run config.yaml --jobs covid-genomes,spike-proteins

Dry-run before committing:

biocurator run config.yaml --dry-run

Usage Examples

Viral genome surveillance

Collect complete SARS-CoV-2 genomes deposited in 2024, filtered for quality:

email: [e-mail]

jobs:
  sars-cov2-2024:
    search:
      databases: [ncbi]
      organism: "SARS-CoV-2"
      sequence_type: nucleotide
      keywords: ["complete genome"]
      max_results: 500
      exclude_terms: [synthetic, artificial, recombinant]
      date_range:
        start: "2024/01/01"
        end: "2024/12/31"
    filter:
      min_length: 29000
      quality_threshold: 0.9
    export:
      outdir: results/sars_2024
      formats: [fasta, csv]
      prefix: sars_cov2_2024

Antibiotic resistance genes

Collect beta-lactamase nucleotide sequences from NCBI:

email: [e-mail]

jobs:
  beta-lactamase:
    search:
      databases: [ncbi]
      sequence_type: nucleotide
      keywords: ["beta-lactamase", "bla gene"]
      max_results: 300
      exclude_terms: [partial, predicted]
    filter:
      min_length: 500
      max_length: 3000
    export:
      outdir: results/amr
      formats: [fasta, csv, json]
      prefix: bla_genes

Multi-database protein family study

Search both NCBI and UniProt for a protein family in the same job:

email: [e-mail]

jobs:
  cytochrome-p450:
    search:
      databases: [ncbi, uniprot]
      sequence_type: protein
      keywords: ["cytochrome P450", "CYP"]
      max_results: 200
    filter:
      min_length: 300
      quality_threshold: 0.8
    export:
      outdir: results/cyp450
      formats: [fasta, csv]
      prefix: cyp450

Multiple independent jobs in one run

email: [e-mail]

jobs:
  spike-proteins:
    search:
      databases: [uniprot]
      organism: "SARS-CoV-2"
      sequence_type: protein
      keywords: ["spike glycoprotein"]
      max_results: 100
    filter:
      min_length: 1200
    export:
      outdir: results/spike
      formats: [fasta]
      prefix: spike

  nucleocapsid-proteins:
    search:
      databases: [uniprot]
      organism: "SARS-CoV-2"
      sequence_type: protein
      keywords: ["nucleocapsid protein"]
      max_results: 100
    filter:
      min_length: 400
    export:
      outdir: results/ncap
      formats: [fasta]
      prefix: ncap

Run them together or selectively:

# All jobs
biocurator run config.yaml

# Only one
biocurator run config.yaml --jobs spike-proteins

Python API

You can drive curation from Python directly using Biocurator.run_job():

from biocurator.core.curator import Biocurator
from biocurator.config.schema import (
    JobConfig, SearchConfig, FilterConfig, ExportConfig,
)

job = JobConfig(
    name="my-job",
    search=SearchConfig(
        databases=["ncbi"],
        organism="SARS-CoV-2",
        sequence_type="nucleotide",
        keywords=["complete genome"],
        max_results=10,
    ),
    filter=FilterConfig(min_length=29000, quality_threshold=0.8),
    export=ExportConfig(outdir="results", formats=["fasta", "csv"], prefix="sars"),
)

curator = Biocurator(email="[e-mail]")
output_files = curator.run_job(job)
# {"fasta": PosixPath("results/sars_sequences.fasta"), "csv": PosixPath("results/sars_metadata.csv")}

Progress callbacks let you integrate with your own UI:

def on_progress(phase: str, current: int, total: int):
    print(f"[{phase}] {current}/{total}")

curator.run_job(job, progress_callback=on_progress)

Load a config file programmatically:

from biocurator.config.loader import ConfigLoader

config = ConfigLoader.load("config.yaml")
curator = Biocurator(email=config.email)

for job in config.jobs:
    output_files = curator.run_job(job)
    print(f"{job.name}: {list(output_files)}")

Output Files

File	Format	Contents
<prefix>_sequences.fasta	FASTA	Downloaded sequences
<prefix>_metadata.csv	CSV	Per-sequence metadata
<prefix>_metadata.json	JSON	Per-sequence metadata (machine-readable)

Troubleshooting

No sequences returned

• Broaden keywords, remove exclude_terms, or increase max_results
• Verify the organism name matches NCBI/UniProt taxonomy exactly

NCBI rate-limit errors

• NCBI enforces 3 requests/second without an API key; the searcher already respects this, but heavy jobs may be slow

InvalidConfigError: 'email' is required

• Add email: [e-mail] at the top level of the YAML

ConfigNotFoundError

• Check the path passed to biocurator run — use --dry-run to validate before downloading

Enable debug logging

biocurator --debug run config.yaml

License

MIT