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chem-solution-md
learningmatter-mit
Set up and run molecular dynamics simulations of molecules in explicit solvent boxes using Packmol for box construction and MLIPs for dynamics.
161GitHub
OPENAGENTSKILL / DIRECTORY
AI Agent Skills
Finde den passenden Skill für deine nächste Aufgabe mit Codex, Claude Code, Cursor und mehr.
Ergebnisse · “molecules”
2 Skills
Ergebnisse: 2
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learningmatter-mit
Search and download experimental InfraRed (IR), Mass spectra, and UV-Vis spectra data (JCAMP-DX format) for molecules.
161GitHub
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