NVIDIA-BioNeMo

50 mods in 2 plugins, 3 repositories, 825 stars between them.

complexa-design

25

NVIDIA-BioNeMo/bionemo-agent-toolkit

Skill Claude Code

End-to-end Proteina-Complexa design pipeline driver. Use when the user wants to "design a binder", "design binders for X", "run complexa design", "de novo binder", "PDL1 binder", "TrkA binder", "design proteins for target", "protein binder design", "ligand binder", "design a small-molecule binder", "ATP-binding…

not rated 484 +4 2d ago A 190 tokens

NVIDIA-BioNeMo/bionemo-agent-toolkit

Skill Claude Code

Standalone evaluation of an existing PDB directory with Proteina-Complexa. Use when the user wants to "evaluate PDB files", "re-fold these designs", "compute interface pAE", "compute ipLDDT for a folder", "run AF2 / RF3 / ESMFold on my designs", "score binder candidates", "designability of this folder", "scRMSD for…

not rated 484 +4 2d ago A 193 tokens

complexa-setup

27

NVIDIA-BioNeMo/bionemo-agent-toolkit

Skill Claude Code

First-time setup, environment configuration, and model-weight installation for Proteina-Complexa. Reach for this skill whenever the user says "set up complexa", "install complexa", "configure my environment file", "first-time setup", "what models do I have installed", "what's in my environment file", "download model…

not rated 484 +4 2d ago A 208 tokens

complexa-sweep

28

NVIDIA-BioNeMo/bionemo-agent-toolkit

Skill Claude Code

Use this skill whenever the user wants to run a parameter sweep over a Proteina-Complexa design pipeline — cartesian-product hyperparameter scans, Pareto search over generation/reward/evaluation knobs, or any "compare configurations" workflow. Trigger phrases include "sweep beam width", "sweep nsteps", "hyperparameter…

not rated 484 +4 2d ago A 173 tokens

complexa-target

29

NVIDIA-BioNeMo/bionemo-agent-toolkit

Skill Claude Code

Use this skill whenever the user wants to add, register, edit, list, show, or validate a Proteina-Complexa design target for any pipeline — protein binder (default), ligand binder, or AME / enzyme scaffolding. Triggers include "add a target", "define a new target for binder design", "register a hotspot", "set up a…

not rated 484 +4 2d ago A 209 tokens

NVIDIA-BioNeMo/bionemo-agent-toolkit

Plugin Claude Code

Bundles 2 skills · 276 tokens together

NVIDIA BioNeMo agent skills for life sciences — protein folding, molecular docking, generative chemistry, genomics, protein design, and biomarker discovery as ready-to-call tools.

not rated 484 +4 2d ago A tokens not measured

route-selection

31

NVIDIA-BioNeMo/bionemo-agent-toolkit

Cursor rule Cursor

Side-by-side comparison of the two de novo binder-design routes (complexa-binder-design vs protein-binder-design) to help choose one for a given target and constraints.

not rated 484 +4 2d ago A 35 tokens

workflow-rules

32

NVIDIA-BioNeMo/bionemo-agent-toolkit

Cursor rule Cursor

Route selection and orchestration for de novo protein binder design. Composes two independent binder-design skills — complexa-binder-design (Proteina-Complexa reward-guided co-design) and protein-binder-design (RFdiffusion + ProteinMPNN + Boltz2/OpenFold3 NIM orchestration). Each resolves a target and hotspots…

not rated 484 +4 2d ago A 119 tokens

codonfm-embed

33

NVIDIA-BioNeMo/bionemo-agent-toolkit

Skill Codex

Validate coding-sequence CSVs, extract public CodonFM/Encodon embeddings, and choose checkpoints for downstream property modeling.

not rated 484 +4 2d ago A 31 tokens

codonfm-finetune

34

NVIDIA-BioNeMo/bionemo-agent-toolkit

Skill Codex

Fine-tune public CodonFM Encodon checkpoints on labeled coding-sequence or coding-variant data using LoRA, head-only, or full fine-tuning. Use when a user explicitly asks to fine-tune CodonFM or Encodon for regression or classification. Support generic public-v1 Encodon workflows only; reject Decodon, MissenseDataset…

not rated 484 +4 2d ago A 90 tokens

codonfm-score

35

NVIDIA-BioNeMo/bionemo-agent-toolkit

Skill Codex

Validate, prepare, or run public CodonFM Encodon masked-codon variant scoring and review compatibility of its scoring workflows. Use only when the user explicitly requests CodonFM or Encodon, or that context is already established in the conversation. Do not select this skill for a generic variant-scoring request…

not rated 484 +4 2d ago A 79 tokens

codonfm-setup

36

NVIDIA-BioNeMo/bionemo-agent-toolkit

Skill Codex

Set up the public CodonFM v1 repository and download public Encodon checkpoints. Use for requests to build or launch the CodonFM development container, configure local data/checkpoint mounts, verify GPU access, or download public Encodon 80M, 600M, 1B, or Cdwt-1B weights. Do not use for Decodon, Encodon 5B/10B…

not rated 484 +4 2d ago A 110 tokens

nvmolkit-usage

37

NVIDIA-BioNeMo/nvMolKit

Skill Claude CodeCodex

Use when writing or debugging nvMolKit Python code for GPU-accelerated RDKit fingerprints, similarity, conformers, clustering, and molecular searches.

not rated 279 changed 15d ago A 37 tokens

fold-cp

38

NVIDIA-BioNeMo/boltz-cp

Plugin Claude Code

Bundles 10 skills, 2 hooks · 1,471 tokens together

Integrate DTensor-based context parallelism (CP) into a custom co-folding / structure-prediction model — sharding the O(N²) pair and attention tensors across a multi-GPU device mesh via explicit ring/transpose collectives. A top-level cpizemodelworkflow conductor prioritizes, sequences, and gates the whole effort end.

not rated 62 +1 19d ago A tokens not measured

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