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Physical Chemistry

Working Paper

Rapid Deconvolution of Low-Resolution Time-of-Flight Data using Bayesian Inference

Cornelius Pieterse, Michiel B. De Kock, Wesley D. Robertson, Hans C. Eggers, R. J. Dwayne Miller

Version 2 posted 30 September 2019

782

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Energy

Working Paper

Using voltammetry augmented with physics-based modeling and Bayesian hypothesis testing to identify analytes in electrolyte solutions

Alexis Fenton, Jr., Fikile Brushett

Version 3 posted 23 August 2021

733

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Theoretical and Computational Chemistry

Working Paper

Bayesian Sequential Stacking Algorithm for Concurrently Designing Molecules and Synthetic Reaction Networks

Qi Zhang, Chang Liu, Stephen Wu, Ryo Yoshida

Version 1 posted 04 April 2022

192

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1

Citations

Nanoscience

Working Paper

Cells Respond to ECM Contexts via Integrin-Ligand Lifetimes: Rediscovery of Loading Rate Enhancement through Bayesian Refinement of Force Spectrum Analysis

Xueyi Yang, Xu Zhang, Yue Xu, Chuanwen Guo, Shenghan Gao, Huitong Jin, Chun Yang

Version 1 posted 12 November 2024

41

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Theoretical and Computational Chemistry

Working Paper

Model selection using replica averaging with Bayesian inference of conformational populations

Robert M. Raddi, Tim Marshall, Yunhui Ge, Vincent Voelz

Version 1 posted 16 August 2023

254

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Theoretical and Computational Chemistry

Working Paper

Encoding prior knowledge in ensemble refinement

Jürgen Köfinger, Gerhard Hummer

Version 3 posted 20 February 2024

359

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Analytical Chemistry

Working Paper

Separating the Effects of Experimental Noise from Inherent System Variability in Voltammetry: The [Fe(CN)_6]^3−/4− Process

Martin Robinson, Alan Bond, Alexandr Simonov, Jie Zhang, David Gavaghan

Version 1 posted 01 October 2018

538

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Theoretical and Computational Chemistry

Working Paper

Metal Cation-Binding Mechanisms of Q-Proline Peptoid Macrocycles in Solution

Matthew Hurley, Justin Northrup, Yunhui Ge, Christian Schafmeister, Vincent Voelz

Version 1 posted 18 January 2021

384

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2

Citations

Energy

Working Paper

Leveraging graphical models to enhance in situ analyte identification via multiple voltammetric techniques

Alexis Fenton, Jr., Fikile Brushett

Version 2 posted 22 February 2023

143

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Theoretical and Computational Chemistry

Working Paper

BICePs v2.0: Software for Ensemble Reweighting using Bayesian Inference of Conformational Populations

Robert Raddi, Yunhui Ge, Vincent Voelz

Version 1 posted 17 October 2022

163

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12 results in Bayesian Inference in Keywords: Bayesian Inference

Rapid Deconvolution of Low-Resolution Time-of-Flight Data using Bayesian Inference

Using voltammetry augmented with physics-based modeling and Bayesian hypothesis testing to identify analytes in electrolyte solutions

Bayesian Sequential Stacking Algorithm for Concurrently Designing Molecules and Synthetic Reaction Networks

Cells Respond to ECM Contexts via Integrin-Ligand Lifetimes: Rediscovery of Loading Rate Enhancement through Bayesian Refinement of Force Spectrum Analysis

Model selection using replica averaging with Bayesian inference of conformational populations

Encoding prior knowledge in ensemble refinement

Separating the Effects of Experimental Noise from Inherent System Variability in Voltammetry: The [Fe(CN)_6]^3−/4− Process

Metal Cation-Binding Mechanisms of Q-Proline Peptoid Macrocycles in Solution

Leveraging graphical models to enhance in situ analyte identification via multiple voltammetric techniques

BICePs v2.0: Software for Ensemble Reweighting using Bayesian Inference of Conformational Populations

12 results in Keywords: Bayesian Inference