Leveraging Implicit Representations of Atomistic Foundation Model for Generation and Optimization of Molecules

Published: 21 Apr 2025, Last Modified: 21 Apr 2025AI4X 2025 OralEveryoneRevisionsBibTeXCC BY 4.0
Keywords: Foundation Model, Molecules Generation, Molecules Optimization
TL;DR: This study proposes a method enhanced with foundation model features to improve molecular reconstruction accuracy, and optimize traditional chemical encodings.
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Submission Number: 30
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