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scientific discovery

Papers

Showing 101125 of 464 papers

TitleStatusHype
Constructing Custom Thermodynamics Using Deep LearningCode1
Offline Model-Based Optimization: Comprehensive ReviewCode1
Olympus: a benchmarking framework for noisy optimization and experiment planningCode1
AbductionRules: Training Transformers to Explain Unexpected InputsCode1
Rethinking Symbolic Regression Datasets and Benchmarks for Scientific DiscoveryCode1
MOOSE-Chem3: Toward Experiment-Guided Hypothesis Ranking via Simulated Experimental FeedbackCode0
Closed-Form Interpretation of Neural Network Classifiers with Symbolic GradientsCode0
MolXPT: Wrapping Molecules with Text for Generative Pre-trainingCode0
ChemNER: Fine-Grained Chemistry Named Entity Recognition with Ontology-Guided Distant SupervisionCode0
APACE: AlphaFold2 and advanced computing as a service for accelerated discovery in biophysicsCode0
Causality Pursuit from Heterogeneous Environments via Neural Adversarial Invariance LearningCode0
Capturing Structure Implicitly from Time-Series having Limited DataCode0
Can Transformers Do Enumerative Geometry?Code0
Matter-of-Fact: A Benchmark for Verifying the Feasibility of Literature-Supported Claims in Materials ScienceCode0
An LLM-based Knowledge Synthesis and Scientific Reasoning Framework for Biomedical DiscoveryCode0
Unsupervised Machine Learning for Scientific Discovery: Workflow and Best PracticesCode0
μ-Bench: A Vision-Language Benchmark for Microscopy UnderstandingCode0
NEBULA: Neural Empirical Bayes Under Latent Representations for Efficient and Controllable Design of Molecular LibrariesCode0
Active Symbolic Discovery of Ordinary Differential Equations via Phase Portrait SketchingCode0
Bridging AI and Science: Implications from a Large-Scale Literature Analysis of AI4ScienceCode0
ALINE: Joint Amortization for Bayesian Inference and Active Data AcquisitionCode0
Physics-tailored machine learning reveals unexpected physics in dusty plasmasCode0
Learning to discover: expressive Gaussian mixture models for multi-dimensional simulation and parameter inference in the physical sciencesCode0
BoxingGym: Benchmarking Progress in Automated Experimental Design and Model DiscoveryCode0
Boolean matrix logic programming for active learning of gene functions in genome-scale metabolic network modelsCode0
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