药物发现论文趋势 2023–2026

主要结论

• 药物发现论文从 2023 年的 79 篇增长到 2026 年的 211 篇，三年间扩大到约 2.7 倍。
• NeurIPS 是发药物发现论文最多的会议，2023–2026 年共 234 篇，占四个会议总量的 40%。
• 交叉方向里涨得最快的是应用 · chemistry physics and earth sciences：同时属于两个主题的论文从 2023 年的 1 篇增至 2026 年的 42 篇。
• 在「健康与生命科学」的 5 个主题里，它的 2026 年论文数排第 2；同组增长最快的临床 NLP是 3.2 倍，药物发现是 2.7 倍。

代表论文

按年份和会议均匀挑选，方便快速看到每一届的样貌

• NeurIPS 2026ACER: Towards Generalizable Protein-ligand Co-folding
• ICML 2026Adaptive Symmetry Discovery for Dynamical System Identification
• ICLR 2026Bures Generalized Category Discovery
• CVPR 2026Learning Like Humans Analogical Concept Learning for Generalized Category Discovery
• NeurIPS 2025AANet: Virtual Screening under Structural Uncertainty via Alignment and Aggregation
• ICML 2025Explicit Discovery of Nonlinear Symmetries from Dynamic Data
• ICLR 2025CBGBench: Fill in the Blank of Protein-Molecule Complex Binding Graph
• CVPR 2025Adaptive Part Learning for Fine-Grained Generalized Category Discovery: A Plug-and-Play Enhancement
• NeurIPS 2024A SARS-CoV-2 Interaction Dataset and VHH Sequence Corpus for Antibody Language Models
• ICML 2024Amortized Equation Discovery in Hybrid Dynamical Systems
• ICLR 2024Self-supervised Pocket Pretraining via Protein Fragment-Surroundings Alignment
• CVPR 2024Federated Generalized Category Discovery
• NeurIPS 2023An Optimization-based Approach To Node Role Discovery in Networks: Approximating Equitable Partitions
• ICML 2023A Group Symmetric Stochastic Differential Equation Model for Molecule Multi-modal Pretraining
• ICLR 2023Context-enriched molecule representations improve few-shot drug discovery
• CVPR 2023Bootstrap Your Own Prior: Towards Distribution-Agnostic Novel Class Discovery
• NeurIPS 2026Active Flow Expansion for Out-of-Distribution Discovery: from Theory to Molecules
• ICML 2026CURE: Consistency-under-Unified Semantic Regularization for Generalized Category Discovery
• ICLR 2026Exploring Synthesizable Chemical Space with Iterative Pathway Refinements
• CVPR 2026TAR Token-Aware Refinement for Fine-grained Generalized Category Discovery

全部药物发现论文

共 23 篇，第 1 / 1 页

1. ICLR 2024A Versatile Causal Discovery Framework to Allow Causally-Related Hidden Variables
2. ICLR 2024Beam Enumeration: Probabilistic Explainability For Sample Efficient Self-conditioned Molecular Design
3. ICLR 2024BioBridge: Bridging Biomedical Foundation Models via Knowledge Graphs
4. ICLR 2024CoLiDE: Concomitant Linear DAG Estimation
5. ICLR 2024Conversational Drug Editing Using Retrieval and Domain Feedback
6. ICLR 2024Cycle Consistency Driven Object Discovery
7. ICLR 2024DecompOpt: Controllable and Decomposed Diffusion Models for Structure-based Molecular Optimization
8. ICLR 2024Equivariant Scalar Fields for Molecular Docking with Fast Fourier Transforms
9. ICLR 2024Federated Causal Discovery from Heterogeneous Data
10. ICLR 2024Mol-Instructions: A Large-Scale Biomolecular Instruction Dataset for Large Language Models
11. ICLR 2024Navigating the Design Space of Equivariant Diffusion-Based Generative Models for De Novo 3D Molecule Generation
12. ICLR 2024ODE Discovery for Longitudinal Heterogeneous Treatment Effects Inference
13. ICLR 2024One-hot Generalized Linear Model for Switching Brain State Discovery
14. ICLR 2024Protein Discovery with Discrete Walk-Jump Sampling
15. ICLR 2024Protein-ligand binding representation learning from fine-grained interactions
16. ICLR 2024Protein-Ligand Interaction Prior for Binding-aware 3D Molecule Diffusion Models
17. ICLR 2024Removing Biases from Molecular Representations via Information Maximization
18. ICLR 2024Rethinking Branching on Exact Combinatorial Optimization Solver: The First Deep Symbolic Discovery Framework
19. ICLR 2024RetroBridge: Modeling Retrosynthesis with Markov Bridges
20. ICLR 2024Rigid Protein-Protein Docking via Equivariant Elliptic-Paraboloid Interface Prediction
21. ICLR 2024Self-supervised Pocket Pretraining via Protein Fragment-Surroundings Alignment
22. ICLR 2024Structural Estimation of Partially Observed Linear Non-Gaussian Acyclic Model: A Practical Approach with Identifiability
23. ICLR 2024Towards Faithful Explanations: Boosting Rationalization with Shortcuts Discovery

常见问题

2023–2026 年四大会议一共有多少篇药物发现论文？

共 578 篇，按年份分别是 2023 年 79 篇、2024 年 125 篇、2025 年 163 篇、2026 年 211 篇。

NeurIPS 2026 有多少篇药物发现论文？

NeurIPS 2026 有 100 篇药物发现论文，上一届是 64 篇。

ICLR 2026 有多少篇药物发现论文？

ICLR 2026 有 37 篇药物发现论文，上一届是 48 篇。

ICML 2026 有多少篇药物发现论文？

ICML 2026 有 63 篇药物发现论文，上一届是 39 篇。

CVPR 2026 有多少篇药物发现论文？

CVPR 2026 有 11 篇药物发现论文，上一届是 12 篇。

哪个会议的药物发现论文最多？

NeurIPS，2023–2026 年共 234 篇。