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UniProt reader for LlamaIndex

Project description

UniProt Reader for LlamaIndex

This package provides a reader for UniProt Swiss-Prot format files, allowing you to load protein data into LlamaIndex for further processing and analysis.

Features

  • Efficient parsing of large UniProt files with optional lazy loading.
  • Structured output with both text containing entire UniProt record and metadata containing protein ID.
  • Configurable field selection

Installation

pip install llama-index-readers-uniprot

Usage

from llama_index.readers.uniprot import UniProtReader

# Initialize the reader
reader = UniProtReader()

# Load data from a UniProt file
documents = reader.load_data("path/to/uniprot_sprot.dat")

# Access the documents
for doc in documents:
    print(f"Protein ID: {doc.metadata['id']}")

Lazy Loading for Large Files

Since UniProt files are large (several GB) it's recommended to use lazy loading to process records one at a time, without loading the entire database into memory:

# Initialize the reader
reader = UniProtReader()

# Load data lazily from a UniProt file
for doc in reader.lazy_load_data("path/to/uniprot_sprot.dat"):
    print(f"Protein ID: {doc.metadata['id']}")
    print("---")

Example of building an index from a lazy loaded UniProt file

from llama_index.readers.uniprot import UniProtReader
from llama_index.core import VectorStoreIndex
from llama_index.core.node_parser import SentenceSplitter

reader = UniProtReader(max_records=10000)

# Load existing protein IDs from the index
existing_protein_ids = {
    node.metadata.get('id')
    for node in index.storage_context.docstore.docs.values()
    if node.metadata.get('id')
}

text_splitter = SentenceSplitter(chunk_size=2048)
index = VectorStoreIndex([], transformations=[text_splitter], show_progress=True)
documents_gen = reader.lazy_load_data("path/to/uniprot_sprot.dat")

# Process documents in batches
batch_size = 10
current_batch = []

for doc in documents_gen:
  protein_id = doc.metadata.get('id')

  if protein_id in existing_protein_ids:
    print(f"Skipping document {protein_id} - already indexed")
    continue


  current_batch.append(doc)

  if len(current_batch) >= batch_size:
      index.refresh_ref_docs(documents=current_batch)
      current_batch = []

# Process any remaining documents
if current_batch:
    index.refresh_ref_docs(documents=current_batch)

# Define persist directory
persist_dir = "path/to/persist/directory"
index.storage_context.persist(persist_dir=persist_dir)

Customizing Field Selection

You can specify which fields to include in the output:

# Only include specific fields
reader = UniProtReader(include_fields={"id", "description", "sequence"})
documents = reader.load_data("path/to/uniprot_sprot.dat")

Available fields:

  • id: Protein identifier
  • accession: Accession numbers
  • description: Protein description
  • gene_names: Gene names
  • organism: Organism name
  • comments: Comments and annotations
  • keywords: Keywords
  • sequence_length: Length of the protein sequence
  • sequence_mw: Molecular weight of the protein
  • taxonomy: Taxonomic classification
  • taxonomy_id: Taxonomic database identifiers
  • citations: Literature citations
  • cross_references: Cross-references to other databases
  • features: Protein features

By default, all fields are included.

Limiting Number of Records

You can limit the number of records to parse using the max_records parameter:

# Parse only first 1000 records
reader = UniProtReader(max_records=1000)
documents = reader.load_data("path/to/uniprot_sprot.dat")

# Works with lazy loading too
for doc in reader.lazy_load_data(
    "path/to/uniprot_sprot.dat", max_records=1000
):
    print(f"Protein ID: {doc.metadata['id']}")

Contributing

We welcome contributions! Please see our contributing guidelines for details.

License

This project is licensed under the MIT License - see the LICENSE file for details.

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