Results 201 to 210 of about 3,213,103 (353)

Combining Bayesian and Evidential Uncertainty Quantification for Improved Bioactivity Modeling. [PDF]

J Chem Inf Model
Khalil B, Schweighofer K, Dyubankova N, van Westen GJP, van Vlijmen H.   +4 more
europepmc   +1 more source

Quantifying Uncertainties in Seismic Tomography [PDF]

, 2005
Michel Cuer, Carole Duffet, Benjamín Ivorra, Bijan Mohammadi   +3 more
openalex  

Uncertainty quantification [PDF]

, 2014
openaire   +1 more source

A Tracer Diffusion Study of Diverse Photo‐Ionic Phenomena in Strontium Titanate

Advanced Functional Materials, EarlyView.
Two strong interfacial photo‐ionic effects are demonstrated for the model system SrTiO3 through the application of isotope exchange experiments: UV illumination is found to enhance the oxygen surface exchange coefficient by several orders of magnitude and to depress the surface space‐charge potential substantially.
David M. Schwenkel, Timon F. Kielgas, George F. Harrington, Roger A. De Souza   +3 more
wiley   +1 more source

Uncertainty Quantification in Molecular Machine Learning for Property Predictions under Data Shifts. [PDF]

J Chem Inf Model
Parrondo-Pizarro R, Lanini J, Rodríguez-Pérez R.   +2 more
europepmc   +1 more source

Integrative Approaches for DNA Sequence‐Controlled Functional Materials

Advanced Functional Materials, EarlyView.
DNA is emerging as a programmable building block for functional materials with applications in biomimicry, biochemical, and mechanical information processing. The integration of simulations, experiments, and machine learning is explored as a means to bridge DNA sequences with macroscopic material properties, highlighting current advances and providing ...
Aaron Gadzekpo, Ewa Anna Oprzeska‐Zingrebe, Mariana Kozlowska, Lennart Hilbert, Iliya D. Stoev   +4 more
wiley   +1 more source

Uncertainty quantification enables reliable deep learning for protein-ligand binding affinity prediction. [PDF]

Sci Rep
Rayka M, Naghavi SS.
europepmc   +1 more source

Exciton Binding Energy Modulation in 2D Perovskites: A Phenomenological Keldysh Framework

Advanced Functional Materials, EarlyView.
The intrinsic screening effects are successfully decoupled from structural distortion by rigorously designing a series of 2D perovskites. This enabled us to demonstrate how the dielectric environment modulates the quasiparticle bandgap and exciton binding energy.
Kitae Kim, Namhee Kwon, Sang Woo Park, Wonsik Kim, Seunghwan Kim, Eunki Yoon, Aelim Ha, Donggyu Lee, Young Yong Kim, Jong‐Cheol Lee, Sungho Lee, Junghan Lee, Kyu Hyoung Lee, Yeonjin Yi, Ki‐Ha Hong, Soohyung Park   +15 more
wiley   +1 more source

Residual bayesian attention networks for uncertainty quantification in regression tasks. [PDF]

Sci Rep
Chen Y, Guan W, Azzam R.
europepmc   +1 more source

Fully Bio‐Based Gelatin Organohydrogels via Enzymatic Crosslinking for Sustainable Soft Strain and Temperature Sensing

Advanced Functional Materials, EarlyView.
Enzymatically crosslinked gelatin‐based organohydrogels, fabricated through a fully bio‐based and scalable process, exhibit exceptional strain and temperature sensing capabilities with minimal interference from environmental humidity. These transparent, stretchable, and ionically conductive materials operate without synthetic fillers or dopants.
Pietro Tordi, Adrián Tamayo, Yeonsu Jeong, Bin Han, Tamer Al Kayal, Aida Cavallo, Massimo Bonini, Paolo Samorì   +7 more
wiley   +1 more source