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pyopenms
Python interface to OpenMS for mass spectrometry data analysis. Use for LC-MS/MS proteomics and metabolomics workflows including file handling (mzML, mzXML, mzTab, FASTA, pepXML, protXML, mzIdentML), signal processing, feature detection, peptide identification, and quantitative analysis. Apply when working with mass spectrometry data, analyzing proteomics experiments, or processing metabolomics da
pysam
Genomic file toolkit. Read/write SAM/BAM/CRAM alignments, VCF/BCF variants, FASTA/FASTQ sequences, extract regions, calculate coverage, for NGS data processing pipelines.
pytdc
Therapeutics Data Commons. AI-ready drug discovery datasets (ADME, toxicity, DTI), benchmarks, scaffold splits, molecular oracles, for therapeutic ML and pharmacological prediction.
python-best-practices
Provides Python patterns for type-first development with dataclasses, discriminated unions, NewType, and Protocol. Must use when reading or writing Python files.
python-database-patterns
SQLAlchemy and database patterns for Python. Triggers on: sqlalchemy, database, orm, migration, alembic, async database, connection pool, repository pattern, unit of work.
biogeobears
Sets up and executes phylogenetic biogeographic analyses using BioGeoBEARS in R for biogeographic reconstruction, ancestral range estimation, and species distribution analysis on phylogenies. It handles input file validation, data reformatting, RMarkdown workflow generation, and result visualization.
python-fastapi-development
Python FastAPI backend development with async patterns, SQLAlchemy, Pydantic, authentication, and production API patterns.
pytorch-lightning
Deep learning framework (PyTorch Lightning). Organize PyTorch code into LightningModules, configure Trainers for multi-GPU/TPU, implement data pipelines, callbacks, logging (W&B, TensorBoard), distributed training (DDP, FSDP, DeepSpeed), for scalable neural network training.
pytorch-lightning
Deep learning framework (PyTorch Lightning). Organize PyTorch code into LightningModules, configure Trainers for multi-GPU/TPU, implement data pipelines, callbacks, logging (W&B, TensorBoard), distributed training (DDP, FSDP, DeepSpeed), for scalable neural network training.
querying-logseq-data
Expert in building Datalog queries for Logseq DB graphs. Auto-invokes when users need help writing Logseq queries, understanding Datalog syntax, optimizing query performance, or working with the Datascript query engine. Covers advanced query patterns, pull syntax, aggregations, and DB-specific query techniques.
qutip
Quantum mechanics simulations and analysis using QuTiP (Quantum Toolbox in Python). Use when working with quantum systems including: (1) quantum states (kets, bras, density matrices), (2) quantum operators and gates, (3) time evolution and dynamics (Schrödinger, master equations, Monte Carlo), (4) open quantum systems with dissipation, (5) quantum measurements and entanglement, (6) visualization (
psql
Run PostgreSQL queries and meta-commands via CLI.