换一批
第一作者：
Yotsawat,Pomyen
第一单位：
Translational Research Unit, Chulabhorn Research Institute, Bangkok, Thailand.
作者：
关键词
AI, Artificial IntelligenceANN, Artificial Neural NetworkAUC, Area Under the receiver-operating characteristic CurveArtificial neural networkCCS value, Collision Cross Section valueCFM-EI, Competitive Fragmentation Modeling-Electron IonizationCNN, Convolutional Neural NetworkDL, Deep LearningDNN, Deep Neural NetworkDeep learningECFP, Extended Circular FingerprintER, Estrogen ReceptorFID, Free Induction DecayFP score, Fingerprint correlation scoreFTIR, Fourier Transform InfraredGC–MS, Gas Chromatography-Mass SpectrometryHDLSS data, High Dimensional Low Sample Size dataIST, Iterative Soft ThresholdingLC-MS, Liquid Chromatography-Mass SpectrometryLSTM, Long Short-Term MemoryML, Machine LearningMLP, Multi-layered PerceptronMS, Mass SpectrometryMass spectrometryMetabolomicsNEIMS, Neural Electron-Ionization Mass SpectrometryNMRNMR, Nuclear Magnetic ResonanceNUS, Non-Uniformly SamplingPARAFAC2, Parallel Factor Analysis 2RF, Random ForestRNN, Recurrent Neural NetworkReLU, Rectified Linear UnitSMARTS, SMILES arbitrary target specificationSMILE, Sparse Multidimensional Iterative Lineshape-enhancedSMILES, Simplified Molecular-Input Line-Entry SystemSRA, Sequence Read ArchiveVAE, Variational AutoencoderistHMS, Implementation of IST at Harvard Medical Schoolm/z, mass/charge ratio
DOI
10.1016/j.csbj.2020.09.033
PMID
33133423
发布时间
2024-03-30
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