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boltz-small-molecule-design

Skill from boltz-bio/boltz-api-skills

Design & Media No risky patterns found curated designapi

Install

npx skills add boltz-bio/boltz-api-skills --skill boltz-small-molecule-design

Runs the open skills CLI and installs the skill for your agent (Claude Code, Codex, Cursor …). Alternatively copy the skill folder into .claude/skills/ or upload it in Claude.ai under Settings → Skills.

As a Claude Code plugin

/plugin marketplace add anthropics/claude-plugins-official /plugin install boltz@boltz-marketplace

This skill is part of the plugin “boltz”. In Claude Code the plugin installs it together with the plugin’s other skills, commands and hooks.

What does the boltz-small-molecule-design skill do?

Design new small-molecule binders with Boltz. Use when generating novel ligands or hits for a target without a fixed compound library. Not for screening existing molecules or one-off docking.

Description from the SKILL.md in the source repository.

Questions about boltz-small-molecule-design

What does the boltz-small-molecule-design skill do?

Design new small-molecule binders with Boltz. Use when generating novel ligands or hits for a target without a fixed compound library. Not for screening existing molecules or one-off docking.

How do I install boltz-small-molecule-design?

In a terminal: npx skills add boltz-bio/boltz-api-skills --skill boltz-small-molecule-design. The skills CLI asks which agents to install it for. In Claude.ai you can upload the skill folder as a ZIP under Settings → Skills.

Which agents can use boltz-small-molecule-design?

Skills use the open SKILL.md format, which Claude Code, Claude.ai, the Claude API, OpenAI Codex, Cursor, Gemini CLI and other agents support.

Is boltz-small-molecule-design safe to use?

Our automatic check found no risky patterns (piped shell scripts, hidden characters, secret access, prompt overrides). It is not a full audit – read the SKILL.md and any scripts before installing.

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boltz-protein-design
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Design new protein binders with Boltz. Use when generating protein, peptide, antibody, nanobody, or custom binder candidates for a target. Not for screening existing proteins or small molecules.

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boltz-protein-screen
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Screen existing protein binders with Boltz. Use when ranking a supplied protein, peptide, antibody, nanobody, or binder library against a target. Not for designing new proteins or screening small molecules.

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boltz-small-molecule-adme
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Predict Tier-1 ADME/ADMET for small molecules with Boltz from bare SMILES — no target, no docking. Use when the user wants solubility, permeability, or lipophilicity/logD for a molecule or list of molecules. Not for ranking molecules against a protein target (use boltz-small-molecule-screen, which already returns ADME free).

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boltz-small-molecule-screen
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Screen existing small-molecule libraries with Boltz. Use when docking, scoring, or ranking a supplied SMILES or compound library against a target. Not for de novo molecule design or one-off docking.

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Predict structures and binding for one defined complex with Boltz. Use when folding a protein, RNA, DNA, or ligand complex, docking one ligand, predicting an interface, or scoring binding. Not for screening libraries or design.

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