iDIA-QC: AI-empowered data-independent acquisition mass spectrometry-based quality control
文献类型: 外文期刊
作者: Gao, Huanhuan 1 ; Zhu, Yi 1 ; Wang, Dongxue 4 ; Nie, Zongxiang 6 ; Wang, He 1 ; Wang, Guibin 4 ; Liang, Shuang 7 ; Xie, Yuting 1 ; Sun, Yingying 1 ; Jiang, Wenhao 1 ; Dong, Zhen 1 ; Qian, Liqin 1 ; Wang, Xufei 8 ; Liang, Mengdi 8 ; Chen, Min 9 ; Fang, Houqi 9 ; Zeng, Qiufang 10 ; Tian, Jiao 10 ; Sun, Zeyu 11 ; Xue, Juan 12 ; Li, Shan 12 ; Chen, Chen 14 ; Liu, Xiang 14 ; Lyu, Xiaolei 14 ; Guo, Zhenchang 15 ; Qi, Yingzi 15 ; Wu, Ruoyu 16 ; Du, Xiaoxian 16 ; Tong, Tingde 15 ; Kong, Fengchun 14 ; Han, Liming 16 ; Wang, Minghui 16 ; Zhao, Yang 17 ; Dai, Xinhua 17 ; He, Fuchu 4 ; Guo, Tiannan 1 ;
作者机构: 1.Westlake Univ, Hangzhou Peoples Hosp 1, Sch Med, State Key Lab Med Prote, Hangzhou, Zhejiang, Peoples R China
2.Westlake Ctr Intelligent Prote, Westlake Lab Life Sci & Biomed, Hangzhou, Zhejiang, Peoples R China
3.Westlake Univ, Sch Life Sci, Res Ctr Ind Future, Hangzhou, Zhejiang, Peoples R China
4.Beijing Inst Life, Beijing Proteome Res Ctr, Natl Ctr Prot Sci Beijing, State Key Lab Med Prote, Beijing, Peoples R China
5.Int Acad Phronesis Med, Guangzhou, Guangdong, Peoples R China
6.Westlake Om Hangzhou Biotechnol Co Ltd, Hangzhou, Peoples R China
7.Zhejiang Acad Agr Sci, Inst Agroprod Safety & Nutr, Hangzhou 310021, Peoples R China
8.Guangzhou Med Univ, Sino French Hoffmann Inst, Sch Basic Med Sci, State Key Lab Resp Dis, Guangzhou, Peoples R China
9.Luming Biotechnol Co Ltd, Shanghai, Peoples R China
10.Shanghai Appl Prot Technol Co Ltd, Shanghai, Peoples R China
11.Zhejiang Univ, State Key Lab Diag & Treatment Infect Dis, Natl Clin Res Ctr Infect Dis, Collaborat Innovat Ctr Diag & Treatment Infect Dis, Hangzhou, Zhejiang, Peoples R China
12.Hubei Univ Med, Taihe Hosp, Inst Infect & Immun, Shiyan, Hubei, Peoples R China
13.Huazhong Agr Univ, Coll Biomed & Hlth, Wuhan, Hubei, Peoples R China
14.SCIEX Ltd, Shanghai, Peoples R China
15.Thermo Fisher Sci, Shanghai, Peoples R China
16.Bruker Daltonics, Beijing, Peoples R China
17.Natl Inst Metrol, Technol Innovat Ctr Mass Spectrometry State Market, Ctr Adv Measurement Sci, Beijing 100029, Peoples R China
期刊名称:NATURE COMMUNICATIONS ( 影响因子:15.7; 五年影响因子:17.2 )
ISSN:
年卷期: 2025 年 16 卷 1 期
页码:
收录情况: SCI
摘要: Quality control (QC) in mass spectrometry (MS)-based proteomics is mainly based on data-dependent acquisition (DDA) analysis of standard samples. Here, we collect 2754 files acquired by data independent acquisition (DIA) and paired 2638 DDA files from mouse liver digests using 21 mass spectrometers across nine laboratories over 31 months. Our data demonstrate that DIA-based LC-MS/MS-related consensus QC metrics exhibit higher sensitivity compared to DDA-based QC metrics in detecting changes in LC-MS status. We then prioritize 15 metrics and invite 21 experts to manually assess the quality of 2754 DIA files based on those metrics. We develop an AI model for DIA-based QC using 2110 training files. It achieves AUCs of 0.91 (LC) and 0.97 (MS) in the first validation dataset (n = 528), and 0.78 (LC) and 0.94 (MS) in an independent validation dataset (n = 116). Finally, we develop an offline software called iDIA-QC for convenient adoption of this methodology.
- 相关文献
作者其他论文 更多>>
-
Chronic toxicity mechanisms of 6PPD and 6PPD-Quinone in zebrafish
作者:Jiao, Fang;Li, Zhongzhi;Lin, Wanjing;Wei, Liangfu;Zhao, Yang;Yue, Qiang;Han, Lingxi;Wei, Liangfu;Wang, Qi;Han, Lingxi;Wei, Liangfu;Wei, Liangfu
关键词:6PPD; 6PPDQ; Hepatotoxicity; PPARg; zebrafish
-
Comparative functional analysis of a new CDR1-like ABC transporter gene in multidrug resistance and virulence between Magnaporthe oryzae and Trichophyton mentagrophytes
作者:Wang, Jing;Xiao, Chenwen;Liang, Shuang;Noman, Muhammad;Cai, Yingying;Zhang, Zhen;Zhu, Xueming;Chai, Rongyao;Qiu, Haiping;Hao, Zhongna;Wang, Yanli;Wang, Jiaoyu;Sun, Guochang;Lin, Fucheng;Bao, Guolian
关键词:
MoCDR1 ;TmCDR1 ; ABC transporters;Magnaporthe oryzae ;Trichophyton mentagrophytes -
Application of the European Non-native Species in Aquaculture Risk Analysis Scheme to evaluate Micropterus nigricans in China
作者:Li, Shan;Li, Fan;Li, Shan;Li, Fan;Wei, Hui;Gu, Dangen;Wei, Hui;Gu, Dangen;Wei, Hui;Gu, Dangen;Kang, Bin;Xu, Dongpo;Xu, Xiaojun;Stauffer, Jay R.;Stauffer, Jay R.
关键词:aquacultural species; risk assessment; freshwater fish; AS-ISK; ENSARS
-
Bacterial extracellular biomolecules-derived multimodal manganese nanoparticles control watermelon Fusarium wilt by dysregulating fusaric acid biosynthesis pathway and precise tuning of rhizosphere metabolome
作者:Noman, Muhammad;Islam, Mohammad Shafiqul;Wang, Jing;Cai, Yingying;Hao, Zhongna;Qiu, Haiping;Zhang, Zhen;Chai, Rongyao;Wang, Yanli;Wang, Jiaoyu;Ahmed, Temoor;Ahmed, Temoor;Islam, Mohammad Shafiqul;Li, Bin;Liang, Shuang;Ali, Hayssam M.
关键词:Fusaric acid; Fusarium wilt; Manganese nanoparticles; Rhizosphere metabolome; Watermelon
-
FK506 Targets MoFpr1 to Modulate Autophagy and Ubiquitination, Inhibiting the Pathogenicity of Magnaporthe oryzae
作者:Zhao, Wen-Hui;Yan, Jiong-Yi;Xie, Ke-Xin;Luo, Xi-Chun;Liao, Jian;An, Chun-Yue;Liu, Xiao-Hong;Yan, Jiong-Yi;Liang, Shuang;Zhu, Xue-Ming;Lin, Fu-Cheng;Wu, Xi-Yu;Qian, Hui;Lu, Jian-Ping;Khan, Irshad Ali
关键词:FK506; X-ray crystallography; riceblast; broad-spectrum antifungal activity
-
Research on the Hormonomics of Three Lilium Species and Their Flavonoid Diversification and Specificity
作者:He, Xuanyu;Huang, Jirong;He, Xuanyu;Zhang, Xueying;Li, Linying;He, Yuqing;Chen, Chaomin;Liang, Shuang;Xu, Zelong;Peng, Chunlan;Hong, Gaojie;Fang, Jie;Lv, Qundan;Hong, Biwei;Zhang, Xueying;Li, Linying;He, Yuqing;Chen, Chaomin;Xu, Zelong;Peng, Chunlan;Hong, Gaojie;Zhang, Xueying;Li, Linying;He, Yuqing;Chen, Chaomin;Xu, Zelong;Peng, Chunlan;Hong, Gaojie
关键词:hormonomics; lily bulbs; metabolites; flavonoids
-
Elucidating the combined toxicity of dimethomorph and difenoconazole: Intergenerational effects on different biological processes in zebrafish
作者:Wang, Dou;Liu, Xinju;Wang, Yanhua;Yang, Guiling;Wang, Yihan;Chen, Chen;Mao, Liangang
关键词:Pesticide; Co-exposure; Transgenerational toxicity; Biological processes



