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home/categories/computational-chemistry/aipoch-medical-research-skills-scientific-skills-evidence-insights-pubchem-database-skill-skill-md
cd ..
computational-chemistryresearch

pubchem-database-skill

Programmatic access to the PubChem database (via PUG-REST API and PubChemPy) for searching chemical compounds, retrieving physicochemical properties, performing structure similarity/substructure searches, and obtaining bioactivity data.

์†Œ์Šค ๋ณด๊ธฐcomputational-chemistry
aipoch
maintainer
aipoch
์—…๋ฐ์ดํŠธ๋จ 2026. 3. 23.
์Šคํƒ€
124
ํฌํฌ
16
quick start

Installation and usage

Programmatic access to the PubChem database (via PUG-REST API and PubChemPy) for searching chemical compounds, retrieving physicochemical properties, performing structure similarity/substructure searches, and obtaining bioactivity data.

์„ค์น˜
$ install --globalskills.sh
์‚ฌ์šฉ๋ฒ•

์„ค์น˜ ํ›„ ํ„ฐ๋ฏธ๋„์—์„œ ๋‹ค์Œ ๋ช…๋ น์„ ์‹คํ–‰ํ•˜์—ฌ ์ด ์Šคํ‚ฌ์„ ์‚ฌ์šฉํ•  ์ˆ˜ ์žˆ์Šต๋‹ˆ๋‹ค:

skills use pubchem-database-skill