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chem-conformer-search
learningmatter-mit
Generate molecular conformers with RDKit ETKDG, relax with MLIPs, and rank by energy with Boltzmann weighting.
161GitHub
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OPENAGENTSKILL / DIRECTORY
AI Agent Skills
Temukan skill untuk tugas berikutnya dengan Codex, Claude Code, Cursor, dan lainnya.
Hasil · “conformer”
2 Skills
Hasil: 2
Unduhan situs
File yang dikirim situs ini sejak 14 Oktober 2026. Satu hitungan per akun masuk, Skill, dan hari UTC. Tidak termasuk situs luar, salinan perintah, atau instalasi. Pembaruan hingga 5 menit.
Skill lainnya
No visual example yet
Explore the skillchem-docking-void
learningmatter-mit
Dock small-molecule guests into a porous host material using the VOID library (Voronoi Clustering), generating multiple 3D conformers with RDKit and ranking generated co…
161GitHub
Lihat skill0Unduhan situs
Panduan & perbandingan
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