chai

chai is a skill for Claude Code, Codex from adaptyvbio/protein-design-skills. It costs 107 tokens per session (1,821 once invoked), scanned A, original, MIT.

A structure-prediction tool for estimating the three-dimensional shape of protein complexes and other molecular assemblies. It can work with proteins, small molecules, DNA, and RNA.

In plain words
What is it for?
Predicting protein-protein and protein-ligand complexes, validating designed binders, and modeling assemblies that include proteins, DNA, or RNA.
Why use it?
It helps check whether designed molecules may form the intended structure before laboratory testing. It also provides an alternative to AlphaFold2 for these prediction tasks.

Skill for Claude CodeCodex

Written for no agent in particular: nothing here depends on one.

Needs its repository: it reads a path above its own folder, which exists only inside the repository. The line is **First time?** See [Getting started](../../docs/getting-started.md) to set up Modal and biomodals..

Good fit Predicting protein-protein and protein-ligand complexes, validating designed binders, and modeling assemblies that include proteins, DNA, or RNA.

Compare 6 skills from other repositories ↓
Install

Getting it into your agent

It runs from inside its repository, so the clone comes first — what it calls does not travel with the file alone.

Clone the repo
git clone --depth 1 https://github.com/adaptyvbio/protein-design-skills
agentmods
npx agentmods add skills/adaptyvbio/protein-design-skills/chai

Made for: Claude Code, Codex.

Wrote this? Show the measurements

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agentmods badge for chai

README.md
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Per session 107 Skills are progressive disclosure: only the name and description are preloaded; the body loads when the skill is used.
When invoked 1,821 The whole file, excluding the scripts and references it only reads on demand.
Security scan A 0 findings. A grade says what 26 rules found in the file — not that it is safe. Third-party audits
  • NVIDIA SkillSpector pass 7 Sept 2026
How audits are shown
Origin original No closer match found in the catalogue.
Token cost

What it costs to keep this loaded

Counted locally with the o200k_base tokenizer, which is exact for GPT models; Claude uses its own tokenizer and its counts differ. Treat this as one consistent yardstick across the catalogue rather than a bill. Prices are per million input tokens.

ModelPer sessionOnce invoked
Fable 5.1 $0.00107 $0.01821
Opus 5 $0.00053 $0.00911
Sonnet 5 $0.00021 $0.00364
Haiku 4.5 $0.00011 $0.00182

Measured 11d ago against content hash 910f20817a2e, method: parsed. Prices are Anthropic first-party input rates as of 2026-09-11, from the pricing page.

Security

Grade A, and why

chai scanned grade A with 0 findings against 26 rules in 11 categories — prompt injection, anti-refusal, data exfiltration, privilege escalation, supply chain, agent snooping, system-prompt leakage, SSRF and excessive agency — measured 11d ago.

A static scan of the body, not an audit. Every finding is printed with the line that produced it so you can judge whether it matters here. A mod is markdown that instructs an agent; that is exactly why what it instructs is worth reading.

Nothing flagged

None of the 26 patterns this scan looks for appear in this file: no shell pipes, no recursive deletes, no credential paths, no hidden text, no instruction-override or anti-refusal phrasing, no agent-config snooping. That is not a guarantee, it is the absence of the things that are checkable.

Origin

Copies of this mod

1 near-identical copy found in the catalogue:

skills/chai/SKILL.md · 273 lines

How it starts

The opening of the file, as written. The whole thing — 273 lines — stays where its author put it; the contents beside it link to each section on GitHub.

Chai-1 Structure Prediction

Prerequisites

Requirement Minimum Recommended
Python 3.10+ 3.11
CUDA 12.0+ 12.1+
GPU VRAM 24GB 40GB (A100)
RAM 32GB 64GB

How to run

First time? See Getting started to set up Modal and biomodals.

Option 1: Modal

cd biomodals
modal run modal_chai1.py \
  --input-faa complex.fasta \
  --out-dir predictions/

GPU: A100 (40GB) | Timeout: 30min default

Option 2: Chai API (recommended)

pip install chai_lab

python -c "
import chai_lab
from chai_lab.chai1 import run_inference

# Run prediction
run_inference(
    fasta_file='complex.fasta',
    output_dir='predictions/',
    num_trunk_recycles=3
)
"

Option 3: Local installation

git clone https://github.com/chaidiscovery/chai-lab.git
cd chai-lab
pip install -e .

chai-lab predict \
  --fasta complex.fasta \
  --output predictions/

FASTA Format

Protein complex

>binder
MKTAYIAKQRQISFVKSHFSRQLE...
>target
MVLSPADKTNVKAAWGKVGAHAGE...

Protein + ligand

>protein
MKTAYIAKQRQISFVKSHFSRQLE...
>ligand|smiles
CCO

Protein + DNA/RNA

>protein
MKTAYIAKQRQISFVKSHFSRQLE...
>dna
ATCGATCGATCG

Key parameters

Parameter Default Range Description
num_trunk_recycles 3 1-10 Recycles (more = better)
num_diffn_timesteps 200 50-500 Diffusion steps
seed 0 int Random seed

Output format

predictions/
├── pred.model_idx_0.cif    # Best model (CIF format)
├── pred.model_idx_1.cif    # Second model
├── scores.json             # Confidence scores
├── pae.npy                 # PAE matrix
└── plddt.npy               # pLDDT values

Note: Chai-1 outputs CIF format. Convert to PDB if needed:

from Bio.PDB import MMCIFParser, PDBIO
parser = MMCIFParser()
structure = parser.get_structure("pred", "pred.model_idx_0.cif")
io = PDBIO()
io.set_structure(structure)
io.save("pred.model_idx_0.pdb")

Read the full file on GitHub · 273 lines

Files

What ships with it

1 file beside SKILL.md in the same directory: the scripts, references and assets a skill reads on demand. Not counted in the per-session cost; read them before you install if any of them is executable.

Changes

What this file has done since we first saw it

Hashed on every crawl. A supply-chain change to an agent config is a question of when, not whether, so the history is kept rather than the latest state alone.

  1. 11d ago First seen · 273 lines · 107 tokens per session scan A 910f20817a2e

Subscribe to this mod's changes

chai is a skill published in the GitHub repository adaptyvbio/protein-design-skills (158 stars, last pushed 3mo ago), licensed MIT. It adds 107 tokens to every session and 1,821 once invoked, about $0.0005 per session on Opus 5. A static security scan graded it A with 0 findings. No closer match exists in the catalogue, so it is treated as the original; first seen 2026-08-30.

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