AdaNovo presents a novel framework for adaptive de novo peptide sequencing, addressing challenges in identifying amino acids with post-translational modifications (PTMs) and dealing with data noise. The model outperforms existing methods on a 9-species benchmark, showcasing superior performance in predicting never-before-seen peptides and identifying amino acids with PTMs.
Tandem mass spectrometry plays a crucial role in proteomics research, enabling the identification of proteins in biological samples. AdaNovo's adaptive training approach based on conditional mutual information enhances precision in peptide-level identification and robustness against data noise.
The model architecture of AdaNovo consists of a mass spectrum encoder and two peptide decoders built on the Transformer. Training strategies include amino acid-level and PSM-level adaptive training to re-weight losses based on CMI values.
Extensive experiments demonstrate AdaNovo's state-of-the-art performance, surpassing previous de novo sequencing methods. The model excels in identifying amino acids with PTMs and demonstrates higher precision levels at both amino acid and peptide levels.
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by Jun Xia,Shao... pada arxiv.org 03-13-2024
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