2 papers
cond-mat.soft2025
Unraveling the Molecular Structure of Lipid Nanoparticles through in-silico Self-Assembly for Rational Delivery Design
Xuan Bai, Yu Lu, Tianhao Yu +7
Lipid nanoparticles (LNPs) are a leading platform in the delivery of RNA-based therapeutics, playing a pivotal role in the clinical success of mRNA vaccines and other nucleic acid…
cs.CL2025
LipidBERT: A Lipid Language Model Pre-trained on METiS de novo Lipid Library
Tianhao Yu, Cai Yao, Zhuorui Sun +10
In this study, we generate and maintain a database of 10 million virtual lipids through METiS's in-house de novo lipid generation algorithms and lipid virtual screening techniques.…