Artificial Intelligence for In Silico Clinical Trials: A Review
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Abstract (arXiv)
A clinical trial is an essential step in drug development, which is often costly and time-consuming. In silico trials are clinical trials conducted digitally through simulation and modeling as an alternative to traditional clinical trials. AI-enabled in silico trials can increase the case group size by creating virtual cohorts as controls. In addition, it also enables automation and optimization of trial design and predicts the trial success rate. This article systematically reviews papers under three main topics: clinical simulation, individualized predictive modeling, and computer-aided trial design. We focus on how machine learning (ML) may be applied in these applications. In particular, we present the machine learning problem formulation and available data sources for each task. We end with discussing the challenges and opportunities of AI for in silico trials in real-world applications.
Key facts. Cited by 6 papers in the map (data through 14 Oct 2026). Builds on 39 of its 108 references that are in the map. First posted on arXiv 16 Sep 2022.
Builds on
39 of 108 references.
References · 39
- 2017Attention Is All You Needcited by 60,361
- 2017A Unified Approach to Interpreting Model Predictionscited by 6,555
- 2022Generative Adversarial Networkscited by 5,627
- 2013Auto-Encoding Variational Bayescited by 4,053
- 2017Improved Training of Wasserstein GANscited by 2,235
- 2019Modeling Tabular data using Conditional GANcited by 699
- 2018Junction Tree Variational Autoencoder for Molecular Graph Generationcited by 652
- 2020The Future of Digital Health with Federated Learningcited by 633
- 2019Reinforcement Learning in Healthcare: A Surveycited by 310
- 2018Scalable and accurate deep learning for electronic health recordscited by 280
- 2015Doctor AI: Predicting Clinical Events via Recurrent Neural Networkscited by 208
- 2017Generating Multi-label Discrete Patient Records using Generative Adversarial Networkscited by 197
27 more
- 2022TransTab: Learning Transferable Tabular Transformers Across Tablescited by 132
- 2017Dipole: Diagnosis Prediction in Healthcare via Attention-based Bidirectional Recurrent Neural Networkscited by 116
- 2019Text-to-SQL Generation for Question Answering on Electronic Medical Recordscited by 77
- 2018MiME: Multilevel Medical Embedding of Electronic Health Records for Predictive Healthcarecited by 72
- 2022MolGenSurvey: A Systematic Survey in Machine Learning Models for Molecule Designcited by 66
- 2019Inferring Which Medical Treatments Work from Reports of Clinical Trialscited by 64
- 2019ConCare: Personalized Clinical Feature Embedding via Capturing the Healthcare Contextcited by 56
- 2021HINT: Hierarchical Interaction Network for Trial Outcome Prediction Leveraging Web Datacited by 49
- 2020StageNet: Stage-Aware Neural Networks for Health Risk Predictioncited by 48
- 2018RAIM: Recurrent Attentive and Intensive Model of Multimodal Patient Monitoring Datacited by 47
- 2021SurvTRACE: Transformers for Survival Analysis with Competing Eventscited by 41
- 2017Multi-Label Classification of Patient Notes a Case Study on ICD Code Assignmentcited by 37
- 2020COMPOSE: Cross-Modal Pseudo-Siamese Network for Patient Trial Matchingcited by 37
- 2020EVA: Generating Longitudinal Electronic Health Records Using Conditional Variational Autoencoderscited by 28
- 2017Boundary-Seeking Generative Adversarial Networkscited by 27
- 2022Trial2Vec: Zero-Shot Clinical Trial Document Similarity Search using Self-Supervisioncited by 18
- 2018Generation of Synthetic Electronic Medical Record Textcited by 14
- 2020Trialstreamer: Mapping and Browsing Medical Evidence in Real-Timecited by 12
- 2019CONAN: Complementary Pattern Augmentation for Rare Disease Detectioncited by 9
- 2020Online Disease Self-diagnosis with Inductive Heterogeneous Graph Convolutional Networkscited by 9
- 2020Modeling Disease Progression in Mild Cognitive Impairment and Alzheimer's Disease with Digital Twinscited by 5
- 2020Generating Digital Twins with Multiple Sclerosis Using Probabilistic Neural Networkscited by 3
- 2020EMIXER: End-to-end Multimodal X-ray Generation via Self-supervisioncited by 3
- 2021Machine Learning Applications for Therapeutic Tasks with Genomics Datacited by 3
- 2022Clinical trial site matching with improved diversity using fair policy learningcited by 3
- 2022CATNet: Cross-event Attention-based Time-aware Network for Medical Event Predictioncited by 2
- 2021A Scalable AI Approach for Clinical Trial Cohort Optimizationcited by 1
Built on by
Citing papers per year: 2022: 1; 2023: 2; 2024: 2; 2025: 1.
6 papers.
- 2022PromptEHR: Conditional Electronic Healthcare Records Generation with Prompt Learningcited by 22
- 2024Uncertainty Quantification on Clinical Trial Outcome Predictioncited by 19
- 2023SPOT: Sequential Predictive Modeling of Clinical Trial Outcome with Meta-Learningcited by 13
- 2023PyTrial: Machine Learning Software and Benchmark for Clinical Trial Applicationscited by 3
- 2024CTP-LLM: Clinical Trial Phase Transition Prediction Using Large Language Modelscited by 2
- 2025SECRET: Semi-supervised Clinical Trial Document Similarity Searchcited by 2
- 2025SECRET: Semi-supervised Clinical Trial Document Similarity Search16 May 2025
- 2024CTP-LLM: Clinical Trial Phase Transition Prediction Using Large Language Models20 Aug 2024
- 2024Uncertainty Quantification on Clinical Trial Outcome Prediction7 Jan 2024
- 2023PyTrial: Machine Learning Software and Benchmark for Clinical Trial Applications6 Jun 2023
- 2023SPOT: Sequential Predictive Modeling of Clinical Trial Outcome with Meta-Learning7 Apr 2023
- 2022PromptEHR: Conditional Electronic Healthcare Records Generation with Prompt Learning11 Oct 2022