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Paper Citation Record · LEDGER

Active and transfer learning with partially Bayesian neural networks for materials and chemicals

As of 14 August 2026, this Paper Citation Record lists 79 of 79 outbound references and 0 inbound Pith citation observations for arXiv:2501.00952.

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pith.paper-citation-record.v1
2501.00952 v2

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Outbound references

Observation b6898fe7-b4ad-4606-8cee-c6c7cfd06842 · outbound

This paper cites Active learning with statistical models.

Active and transfer learning with partially Bayesian neural networks for materials and chemicals Active learning with statistical models

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Active and transfer learning with partially Bayesian neural networks for materials and chemicals Active Learning Literature Survey

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This paper cites Active learning accelerates the discovery of high strength and high ductility lead-free solder alloys.

Active and transfer learning with partially Bayesian neural networks for materials and chemicals Active learning accelerates the discovery of high strength and high ductility lead-free solder alloys

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This paper cites Benchmarking active learning strategies for materials optimization and discovery.

Active and transfer learning with partially Bayesian neural networks for materials and chemicals Benchmarking active learning strategies for materials optimization and discovery

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This paper cites Small data machine learning in materials science.

Active and transfer learning with partially Bayesian neural networks for materials and chemicals Small data machine learning in materials science

Reference 6

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This paper cites Bayesian Conavigation: Dynamic Designing of the Material Digital Twins via Active Learning.

Active and transfer learning with partially Bayesian neural networks for materials and chemicals Bayesian Conavigation: Dynamic Designing of the Material Digital Twins via Active Learning

Reference 7

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This paper cites Bayesian Active Learning for Scanning Probe Microscopy: From Gaussian Processes to Hypothesis Learning.

Active and transfer learning with partially Bayesian neural networks for materials and chemicals Bayesian Active Learning for Scanning Probe Microscopy: From Gaussian Processes to Hypothesis Learning

Reference 8

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This paper cites Phase Stability Through Machine Learning.

Active and transfer learning with partially Bayesian neural networks for materials and chemicals Phase Stability Through Machine Learning

Reference 9

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This paper cites Data-driven analysis and prediction of stable phases for high-entropy alloy design.

Active and transfer learning with partially Bayesian neural networks for materials and chemicals Data-driven analysis and prediction of stable phases for high-entropy alloy design

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This paper cites A comparative study of predicting high entropy alloy phase fractions with traditional machine learning and deep neural networks.

Active and transfer learning with partially Bayesian neural networks for materials and chemicals A comparative study of predicting high entropy alloy phase fractions with traditional machine learning and deep neural networks

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This paper cites Exploring high thermal conductivity polymers via interpretable machine learning with physical descriptors.

Active and transfer learning with partially Bayesian neural networks for materials and chemicals Exploring high thermal conductivity polymers via interpretable machine learning with physical descriptors

Reference 12

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This paper cites Predicting lattice thermal conductivity via machine learning: a mini review.

Active and transfer learning with partially Bayesian neural networks for materials and chemicals Predicting lattice thermal conductivity via machine learning: a mini review

Reference 13

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This paper cites Interpretable Machine Learning Model on Thermal Conductivity Using Publicly Available Datasets and Our Internal Lab Dataset.

Active and transfer learning with partially Bayesian neural networks for materials and chemicals Interpretable Machine Learning Model on Thermal Conductivity Using Publicly Available Datasets and Our Internal Lab Dataset

Reference 14

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This paper cites Finding Unprecedentedly Low-Thermal-Conductivity Half-Heusler Semiconductors via High-Throughput Materials Modeling.

Active and transfer learning with partially Bayesian neural networks for materials and chemicals Finding Unprecedentedly Low-Thermal-Conductivity Half-Heusler Semiconductors via High-Throughput Materials Modeling

Reference 15

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Active and transfer learning with partially Bayesian neural networks for materials and chemicals Prediction of glass transition temperature of oxide glasses based on interpretable machine learning and sparse data sets

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Active and transfer learning with partially Bayesian neural networks for materials and chemicals Data-driven machine learning prediction of glass transition temperature and the glass-forming ability of metallic glasses

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Active and transfer learning with partially Bayesian neural networks for materials and chemicals Machine-Learning-Based Prediction of the Glass Transition Temperature of Organic Compounds Using Experimental Data

Reference 18

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Active and transfer learning with partially Bayesian neural networks for materials and chemicals Predicting glass transition temperature and melting point of organic compounds via machine learning and molecular embeddings

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Active and transfer learning with partially Bayesian neural networks for materials and chemicals Interpretable Machine Learning Framework to Predict the Glass Transition Temperature of Polymers

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Active and transfer learning with partially Bayesian neural networks for materials and chemicals Accurate prediction of dielectric properties and bandgaps in materials with a machine learning approach

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Active and transfer learning with partially Bayesian neural networks for materials and chemicals Machine learning dielectric screening for the simulation of excited state properties of molecules and materials

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Active and transfer learning with partially Bayesian neural networks for materials and chemicals Delta Machine Learning for Predicting Dielectric Properties and Raman Spectra

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Active and transfer learning with partially Bayesian neural networks for materials and chemicals Machine learning and atomistic origin of high dielectric permittivity in oxides

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Active and transfer learning with partially Bayesian neural networks for materials and chemicals Opportunities and Challenges for Machine Learning in Materials Science

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Active and transfer learning with partially Bayesian neural networks for materials and chemicals Advances of machine learning in materials science: Ideas and techniques

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Active and transfer learning with partially Bayesian neural networks for materials and chemicals Explainable machine learning in materials science

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Active and transfer learning with partially Bayesian neural networks for materials and chemicals Recent advances and applications of machine learning in solid-state materials science

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Active and transfer learning with partially Bayesian neural networks for materials and chemicals Confidence intervals for random forests: the jackknife and the infinitesimal jackknife

Reference 29

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Active and transfer learning with partially Bayesian neural networks for materials and chemicals On calibration of modern neural networks

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Active and transfer learning with partially Bayesian neural networks for materials and chemicals FFMDFPA: A FAIRification Framework for Materials Data with No-Code Flexible Semi-Structured Parser and Application Programming Interfaces

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Active and transfer learning with partially Bayesian neural networks for materials and chemicals Data-Driven Materials Science: Status, Challenges, and Perspectives

Reference 32

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Active and transfer learning with partially Bayesian neural networks for materials and chemicals Enhancing materials property prediction by leveraging computational and experimental data using deep transfer learning

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Active and transfer learning with partially Bayesian neural networks for materials and chemicals Unresolved cited work

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Active and transfer learning with partially Bayesian neural networks for materials and chemicals Practical Bayesian Optimization of Machine Learning Algorithms

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Active and transfer learning with partially Bayesian neural networks for materials and chemicals Surrogates: Gaussian Process Modeling, Design, and Optimization for the Applied Sciences

Reference 36

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This paper cites Gaussian process regression for materials and molecules.

Active and transfer learning with partially Bayesian neural networks for materials and chemicals Gaussian process regression for materials and molecules

Reference 37

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Active and transfer learning with partially Bayesian neural networks for materials and chemicals Manifold Gaussian Processes for regression

Reference 38

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This paper cites Deep Kernel Learning.

Active and transfer learning with partially Bayesian neural networks for materials and chemicals Deep Kernel Learning

Reference 39

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Active and transfer learning with partially Bayesian neural networks for materials and chemicals Stochastic variational deep kernel learning

Reference 40

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Active and transfer learning with partially Bayesian neural networks for materials and chemicals Deep Kernel learning for reaction outcome prediction and optimization

Reference 41

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Active and transfer learning with partially Bayesian neural networks for materials and chemicals Deep kernel learning improves molecular fingerprint prediction from tandem mass spectra

Reference 42

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Active and transfer learning with partially Bayesian neural networks for materials and chemicals Deep kernel methods learn better: from cards to process optimization

Reference 43

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This paper cites The promises and pitfalls of deep kernel learning.

Active and transfer learning with partially Bayesian neural networks for materials and chemicals The promises and pitfalls of deep kernel learning

Reference 44

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This paper cites Bayesian Methods for Neural Networks and Related Models.

Active and transfer learning with partially Bayesian neural networks for materials and chemicals Bayesian Methods for Neural Networks and Related Models

Reference 45

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This paper cites Bayesian approach for neural networks—review and case studies.

Active and transfer learning with partially Bayesian neural networks for materials and chemicals Bayesian approach for neural networks—review and case studies

Reference 46

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This paper cites Conference Paper.

Active and transfer learning with partially Bayesian neural networks for materials and chemicals Conference Paper

Reference 47

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Observation 648e6135-9f53-4c01-b0c3-42bad0e33099 · outbound

This paper cites A Baseline for Detecting Misclassified and Out-of-Distribution Examples in Neural Networks.

Active and transfer learning with partially Bayesian neural networks for materials and chemicals A Baseline for Detecting Misclassified and Out-of-Distribution Examples in Neural Networks

Reference 48

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Observation 98df5d5e-ca5c-4ce7-99ed-1caac9e99ddf · outbound

This paper cites Simple and Scalable Predictive Uncertainty Estimation using Deep Ensembles.

Active and transfer learning with partially Bayesian neural networks for materials and chemicals Simple and Scalable Predictive Uncertainty Estimation using Deep Ensembles

Reference 49

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Observation 289e14fe-d566-4ea2-8b82-cc293e34730d · outbound

This paper cites Monte Carlo Sampling Methods Using Markov Chains and Their Applications.

Active and transfer learning with partially Bayesian neural networks for materials and chemicals Monte Carlo Sampling Methods Using Markov Chains and Their Applications

Reference 50

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Observation 7162ea11-04b6-48e6-a630-53a995c5a70e · outbound

This paper cites A Conceptual Introduction to Hamiltonian Monte Carlo.

Active and transfer learning with partially Bayesian neural networks for materials and chemicals A Conceptual Introduction to Hamiltonian Monte Carlo

Reference 52

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Observation 54f87e9d-b3d2-4ffc-a541-296671ece82e · outbound

This paper cites Yes, but Did It Work?: Evaluating Variational Inference.

Active and transfer learning with partially Bayesian neural networks for materials and chemicals Yes, but Did It Work?: Evaluating Variational Inference

Reference 53

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Observation 1d41fe69-f8ab-455e-82ad-05581fa8833b · outbound

This paper cites The No-U-turn sampler: adaptively setting path lengths in Hamiltonian Monte Carlo.

Active and transfer learning with partially Bayesian neural networks for materials and chemicals The No-U-turn sampler: adaptively setting path lengths in Hamiltonian Monte Carlo

Reference 54

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Observation a814c1d6-acb2-4332-bb0b-9d33d70ce3b3 · outbound

This paper cites What uncertainties do we need in Bayesian deep learning for computer vision?.

Active and transfer learning with partially Bayesian neural networks for materials and chemicals What uncertainties do we need in Bayesian deep learning for computer vision?

Reference 55

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Observation 118874ac-c17d-4f5a-ab4e-a5fbe93b91c0 · outbound

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Active and transfer learning with partially Bayesian neural networks for materials and chemicals Weight Uncertainty in Neural Network

Reference 56

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Active and transfer learning with partially Bayesian neural networks for materials and chemicals Laplace Redux - Effortless Bayesian Deep Learning

Reference 57

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Observation fbc2bc76-f066-441c-b538-890befa2ccb3 · outbound

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Active and transfer learning with partially Bayesian neural networks for materials and chemicals Unresolved cited work

Reference 58

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Active and transfer learning with partially Bayesian neural networks for materials and chemicals Bayesian learning via stochastic gradient langevin dynamics

Reference 59

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This paper cites On the expressiveness of approximate inference in Bayesian neural networks.

Active and transfer learning with partially Bayesian neural networks for materials and chemicals On the expressiveness of approximate inference in Bayesian neural networks

Reference 60

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Observation 7b762c80-a05b-40ee-bdc7-d801be70c65e · outbound

This paper cites Variational Inference: A Review for Statisticians.

Active and transfer learning with partially Bayesian neural networks for materials and chemicals Variational Inference: A Review for Statisticians

Reference 61

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This paper cites Good Initializations of Variational Bayes for Deep Models.

Active and transfer learning with partially Bayesian neural networks for materials and chemicals Good Initializations of Variational Bayes for Deep Models

Reference 62

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Observation b0ff43f7-8a1a-43fd-9fbd-4e2653adb477 · outbound

This paper cites Do Bayesian Neural Networks Need To Be Fully Stochastic?.

Active and transfer learning with partially Bayesian neural networks for materials and chemicals Do Bayesian Neural Networks Need To Be Fully Stochastic?

Reference 63

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Observation d09fe83d-15ae-4b9b-b0c4-13f76bcdf59e · outbound

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Active and transfer learning with partially Bayesian neural networks for materials and chemicals Variational Bayesian Last Layers

Reference 64

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Observation 350da848-b57f-47c7-a6bf-fe3010bd34d8 · outbound

This paper cites Averaging Weights Leads to Wider Optima and Better Generalization.

Active and transfer learning with partially Bayesian neural networks for materials and chemicals Averaging Weights Leads to Wider Optima and Better Generalization

Reference 65

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Observation 5287ce85-0be7-4376-81b9-7dc9cf629440 · outbound

This paper cites Empirical Frequentist Coverage of Deep Learning Uncertainty Quantification Procedures.

Active and transfer learning with partially Bayesian neural networks for materials and chemicals Empirical Frequentist Coverage of Deep Learning Uncertainty Quantification Procedures

Reference 66

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Observation fef54807-6764-45d8-9615-a353f4f6d34f · outbound

This paper cites How to evaluate uncertainty estimates in machine learning for regression?.

Active and transfer learning with partially Bayesian neural networks for materials and chemicals How to evaluate uncertainty estimates in machine learning for regression?

Reference 67

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This paper cites RDKit: Open-source cheminformatics: https://www.rdkit.org.

Active and transfer learning with partially Bayesian neural networks for materials and chemicals RDKit: Open-source cheminformatics: https://www.rdkit.org

Reference 68

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Observation 88bf4ed9-d18f-4e52-9add-e4d6b0c6b7e4 · outbound

This paper cites A general-purpose machine learning framework for predicting properties of inorganic materials.

Active and transfer learning with partially Bayesian neural networks for materials and chemicals A general-purpose machine learning framework for predicting properties of inorganic materials

Reference 69

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Observation e34bf17d-5fd3-486f-9d2e-2c785631d228 · outbound

This paper cites FreeSolv: a database of experimental and calculated hydration free energies, with input files.

Active and transfer learning with partially Bayesian neural networks for materials and chemicals FreeSolv: a database of experimental and calculated hydration free energies, with input files

Reference 70

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Observation 3a6f815a-ba54-474c-8127-0af53628ddd4 · outbound

This paper cites ESOL: Estimating Aqueous Solubility Directly from Molecular Structure.

Active and transfer learning with partially Bayesian neural networks for materials and chemicals ESOL: Estimating Aqueous Solubility Directly from Molecular Structure

Reference 71

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Observation 0bddc98d-8d70-41b8-b4f2-7fed2dec01f3 · outbound

This paper cites Exploration of data science techniques to predict fatigue strength of steel from composition and processing parameters.

Active and transfer learning with partially Bayesian neural networks for materials and chemicals Exploration of data science techniques to predict fatigue strength of steel from composition and processing parameters

Reference 72

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Observation 56e8bceb-dad1-4e9b-bef0-6f75fee8f83a · outbound

This paper cites An open experimental database for exploring inorganic materials.

Active and transfer learning with partially Bayesian neural networks for materials and chemicals An open experimental database for exploring inorganic materials

Reference 73

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Observation 29a36cff-7605-4a93-b371-9da2b5180961 · outbound

This paper cites Commentary: The Materials Project: A materials genome approach to accelerating materials innovation.

Active and transfer learning with partially Bayesian neural networks for materials and chemicals Commentary: The Materials Project: A materials genome approach to accelerating materials innovation

Reference 74

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Observation 8ae9bc81-f108-4ebf-8e60-9e47587b8823 · outbound

This paper cites Predicting the Band Gaps of Inorganic Solids by Machine Learning.

Active and transfer learning with partially Bayesian neural networks for materials and chemicals Predicting the Band Gaps of Inorganic Solids by Machine Learning

Reference 75

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Active and transfer learning with partially Bayesian neural networks for materials and chemicals Active Learning with Fully Bayesian Neural Networks for Discontinuous and Nonstationary Data

Reference 76

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Observation 2e0cc70b-6272-4982-95cc-05566304bdd4 · outbound

This paper cites MoleculeNet: A Benchmark for Molecular Machine Learning.

Active and transfer learning with partially Bayesian neural networks for materials and chemicals MoleculeNet: A Benchmark for Molecular Machine Learning

Reference 77

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Observation cdbe83b9-ec2e-4cf0-95a5-682f8a4ca60b · outbound

This paper cites Inference from Iterative Simulation Using Multiple Sequences.

Active and transfer learning with partially Bayesian neural networks for materials and chemicals Inference from Iterative Simulation Using Multiple Sequences

Reference 78

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Observation 475f3311-7367-45b5-bd9d-c30a6bd84e95 · outbound

This paper cites General Methods for Monitoring Convergence of Iterative Simulations.

Active and transfer learning with partially Bayesian neural networks for materials and chemicals General Methods for Monitoring Convergence of Iterative Simulations

Reference 79

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This paper cites URL: https://www.sciencedirect.

Active and transfer learning with partially Bayesian neural networks for materials and chemicals URL: https://www.sciencedirect

Reference 4928

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Observation 640fa424-a7e1-4e72-83fe-f277005f2b3e · outbound

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Active and transfer learning with partially Bayesian neural networks for materials and chemicals Unresolved cited work

Reference 5497

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Pith citing papers

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