← 返回 Skills 市场
113
总下载
0
收藏
0
当前安装
1
版本数
在 OpenClaw 中安装
/install smiles-de-salter
功能描述
Analyze data with `smiles-de-salter` using a reproducible workflow, explicit validation, and structured outputs for review-ready interpretation.
安全使用建议
This skill appears to do what it claims: locally parse SMILES and remove salt fragments. Before installing/using it: 1) Run the recommended smoke checks (python -m py_compile scripts/main.py and python scripts/main.py --help) in a sandboxed environment. 2) Ensure RDKit is installed correctly for your platform (many users install RDKit via conda rather than pip). 3) Test with a small sample file to confirm behavior and edge cases (the heuristic may misclassify unusual ions). 4) Review inputs for any sensitive data before processing and ensure outputs are stored where you intend. 5) If you need network-isolated execution or stricter auditing, run the script in a contained environment (container or VM).
功能分析
Type: OpenClaw Skill
Name: smiles-de-salter
Version: 1.0.0
The skill bundle is a legitimate tool for chemical informatics, specifically for desalting SMILES strings using the RDKit library. The Python script `scripts/main.py` implements standard heuristic-based molecular fragmentation logic without any signs of data exfiltration, unauthorized network access, or malicious execution. The `SKILL.md` instructions are well-structured, align perfectly with the code's functionality, and include proactive security checklists and validation steps.
能力评估
Purpose & Capability
Name/description match the provided artifacts: a single Python script (scripts/main.py) plus SKILL.md and references. Declared dependencies (RDKit, pandas) align with chemical SMILES parsing and tabular IO. No unrelated binaries, credentials, or config paths are requested.
Instruction Scope
SKILL.md restricts runtime actions to validating inputs, compiling/running scripts/main.py, and processing input files. The instructions do not ask the agent to read unrelated system files, access secrets, or transmit data externally. Fallback/error handling is explicit and limited to local reporting.
Install Mechanism
This is an instruction-only skill (no install spec) and includes a requirements.txt listing pandas and rdkit. That is proportionate. Note: installing RDKit can be non-trivial on some systems (often requiring conda or platform-specific wheels); the SKILL.md suggests `pip install rdkit pandas`, which may fail in many environments. This is an operational/compatibility note, not a security concern.
Credentials
No environment variables, credentials, or config paths are required. The script operates on user-provided input/output files only, which is proportionate to the stated functionality.
Persistence & Privilege
Flags show normal defaults (always: false, model invocation allowed). The skill does not request permanent presence or attempt to modify other skills or global configs.
如何使用
- 确保已安装 OpenClaw（本地或 Docker 部署）
- 在对话框中输入安装命令：
/install smiles-de-salter - 安装完成后，直接呼叫该 Skill 的名称或使用
/smiles-de-salter触发 - 根据 Skill 的参数说明提供必要输入，即可获得结构化输出
版本历史
v1.0.0
smiles-de-salter v1.0.0
- Initial release of smiles-de-salter skill for batch de-salting of chemical SMILES strings.
- Provides a reproducible workflow for identifying and removing salt ions, retaining only the core compound.
- Supports structured outputs, explicit input validation, and review-ready results.
- Command-line tool with parameterized input/output control, status messages, and error handling.
- Includes comprehensive documentation for usage, salt type handling, input/output formats, and edge cases.
元数据
常见问题
SMILES De-salter 是什么？
Analyze data with `smiles-de-salter` using a reproducible workflow, explicit validation, and structured outputs for review-ready interpretation. 它是一个面向 Claude Code / OpenClaw 的 AI Agent Skill 插件，目前累计下载 113 次。
如何安装 SMILES De-salter？
在 OpenClaw 或 Claude Code 对话框中运行命令「/install smiles-de-salter」即可一键安装，无需额外配置。
SMILES De-salter 是免费的吗？
是的，SMILES De-salter 完全免费，采用 MIT-0 许可证，可自由下载、安装和使用。
SMILES De-salter 支持哪些平台？
SMILES De-salter 跨平台运行，可在任意部署了 OpenClaw / Claude Code 的环境中使用（cross-platform）。
谁开发了 SMILES De-salter？
由 AIpoch（@aipoch-ai）开发并维护，当前版本 v1.0.0。
推荐 Skills