Phenotype-Guided In Silico Molecular Generation Using Large Language Models
Qun Jiang, Xing Ye, Zekun Guo…·Sida Shao
GEMGen generates small molecules from transcriptomic data to phenocopy gene knockdown effects and identify novel inhibitors.
Author
Chinese Academy of SciencesORCID 0000-0002-0467-7858Unclaimed ORCID profile · follow to get notified of new preprints
8 papers
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Qun Jiang, Xing Ye, Zekun Guo…·Sida Shao
GEMGen generates small molecules from transcriptomic data to phenocopy gene knockdown effects and identify novel inhibitors.
Jianwei Zhu, Yu Shi, Ran Bi…·Tao Qin
FlexRibbon is a pretrained protein model that jointly learns from sequences and structures, achieving state-of-the-art performance in mutation-rich settings.
Tianze Wang, Yan Pan, Fusong Ju…·Pan Deng
CellNavi predicts driver genes for cell state transitions using a deep learning framework that integrates gene graphs with transcriptomics data across diverse cell types and perturbations.
Haoran Sun, Liang He, Pan Deng…·Tie‐Yan Liu
The paper introduces {micro}Protein, a framework combining deep learning and reinforcement learning to predict and discover high-gain protein mutants using single mutation data.
Yongge Li, Fusong Ju, Zhiyuan Chen…·Pan Deng
CREaTor models cis-regulatory patterns using attention mechanisms and RNA-seq/ChIP-seq data, outperforming existing methods in predicting cCRE-gene interactions across cell types.
Tiansu Gong, Fusong Ju, Dongbo Bu
KnotFold predicts RNA secondary structures including pseudoknots with higher accuracy than existing methods by combining learned potentials with a minimum-cost flow algorithm.
Lupeng Kong, Fusong Ju, Wei‐Mou Zheng…·Dongbo Bu
ProALIGN improves protein structure prediction by learning optimal sequence-template alignments using deep learning, outperforming existing methods on multiple datasets.
Fusong Ju, Jianwei Zhu, Bin Shao…·Dongbo Bu
CopulaNet directly learns residue co-evolution from multiple sequence alignments to improve protein structure prediction accuracy and efficiency.