/tools/dZiner

dZiner

mehradans92/dZiner

42 stars7 forksJupyter NotebookWebsiteAdded February 5, 2026
summary

dZiner is an AI framework designed for the rational inverse design of materials, allowing for the generation and assessment of new molecular candidates based on user-defined properties and constraints. It incorporates a human-in-the-loop approach to refine designs and improve chemical feasibility.

description

Chemist AI Agent for Rational Inverse Design of Materials

topics

ai-agentsinverse-material-designhuman-in-the-loop

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