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PDF] A graph representation of molecular ensembles for polymer property prediction
Accelerating amorphous polymer electrolyte screening by learning to reduce errors in molecular dynamics simulated properties
TransPolymer: a Transformer-based language model for polymer property predictions
TransPolymer: a Transformer-based Language Model for Polymer Property Predictions
Bidirectional generation of structure and properties through a single molecular foundation model
Changwen Xu - Redesign Science
Research on composition-process-property prediction of die casting Al alloys via combining feature creation and attention mechanisms - ScienceDirect
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Transformer-Based Language Model Writes Abstracts For Scientific Papers