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Found 3 papers, 2 papers with code
DeepDriveMD: Deep-Learning Driven Adaptive Molecular Simulations for Protein Folding
Our study provides a quantitative basis to understand how DL driven MD simulations, can lead to effective performance gains and reduced times to solution on supercomputing resources.
ProtTrans: Towards Cracking the Language of Life's Code Through Self-Supervised Deep Learning and High Performance Computing
Here, we trained two auto-regressive models (Transformer-XL, XLNet) and four auto-encoder models (BERT, Albert, Electra, T5) on data from UniRef and BFD containing up to 393 billion amino acids.
Ranked #1 on
Protein Secondary Structure Prediction
on CASP12
Dimensionality Reduction
Protein Secondary Structure Prediction
Transferring a molecular foundation model for polymer property predictions
Transformer-based large language models have remarkable potential to accelerate design optimization for applications such as drug development and materials discovery.
