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A massively parallel semi-Lagrangian solver for the six-dimensional Vlasov–Poisson equation

The international journal of high performance computing applications, 2019-09, Vol.33 (5), p.924-947

2019

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Efficient all-electron hybrid density functionals for atomistic simulations beyond 10 000 atoms

The Journal of chemical physics, 2024-07, Vol.161 (2)

2024

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NECI: N-Electron Configuration Interaction with an emphasis on state-of-the-art stochastic methods

The Journal of chemical physics, 2020-07, Vol.153 (3), p.034107-034107

2020

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Dnmt2-dependent methylomes lack defined DNA methylation patterns

Proceedings of the National Academy of Sciences - PNAS, 2013-05, Vol.110 (21), p.8627-8631

2013

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Quantitative three-dimensional imaging of chemical short-range order via machine learning enhanced atom probe tomography

Nature communications, 2023-11, Vol.14 (1), p.7410-7410, Article 7410

2023

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The genome of the square archaeon Haloquadratum walsbyi : life at the limits of water activity

BMC genomics, 2006-07, Vol.7 (1), p.169-169, Article 169

2006

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BioEM: GPU-accelerated computing of Bayesian inference of electron microscopy images

Computer physics communications, 2017-01, Vol.210, p.163-171

2017

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Convolutional neural network-assisted recognition of nanoscale L12 ordered structures in face-centred cubic alloys

npj computational materials, 2021-01, Vol.7 (1), p.1-9, Article 8

2021

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Metagenomics to Paleogenomics: Large-Scale Sequencing of Mammoth DNA

Science (American Association for the Advancement of Science), 2006-01, Vol.311 (5759), p.392-394

2006

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Haloquadratum walsbyi: limited diversity in a global pond

PloS one, 2011-06, Vol.6 (6), p.e20968-e20968

2011

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Toward Gravitational Wave Signals from Realistic Core-Collapse Supernova Models

The Astrophysical journal, 2004-03, Vol.603 (1), p.221-230

2004

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nsCouette – A high-performance code for direct numerical simulations of turbulent Taylor–Couette flow

SoftwareX, 2020-01, Vol.11 (C), p.100395, Article 100395

2020

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The complete genome sequence of Thermoproteus tenax: a physiologically versatile member of the Crenarchaeota

PloS one, 2011-10, Vol.6 (10), p.e24222-e24222

2011

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Validation tests for cryo-EM maps using an independent particle set

Journal of structural biology. X, 2020-01, Vol.4, p.100032-100032, Article 100032

2020

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Electron Neutrino Pair Annihilation: A New Source for Muon and Tau Neutrinos in Supernovae

The Astrophysical journal, 2003-04, Vol.587 (1), p.320-326

2003

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Pre-Exascale Computing of Protein–Ligand Binding Free Energies with Open Source Software for Drug Design

Journal of chemical information and modeling, 2022-03, Vol.62 (5), p.1172-1177

2022

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Direct recognition of crystal structures via three-dimensional convolutional neural networks with high accuracy and tolerance to random displacements and missing atoms

Scripta materialia, 2023-09, Vol.234, p.115542, Article 115542

2023

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An efficient particle tracking algorithm for large-scale parallel pseudo-spectral simulations of turbulence

Computer physics communications, 2022-09, Vol.278, p.108406, Article 108406

2022

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Evaluation of performance portability frameworks for the implementation of a particle‐in‐cell code

Concurrency and computation, 2020-06, Vol.32 (11), p.n/a

2020

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3D deep learning for enhanced atom probe tomography analysis of nanoscale microstructures

Acta materialia, 2024-10, Vol.278, p.120280, Article 120280

2024

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A blueprint of ectoine metabolism from the genome of the industrial producer Halomonas elongata DSM 2581T

Environmental microbiology, 2011-08, Vol.13 (8), p.1973-1994

2011

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Code modernization strategies for short-range non-bonded molecular dynamics simulations

Computer physics communications, 2023-09, Vol.290, p.108760, Article 108760

2023

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FaVAD: A software workflow for characterization and visualizing of defects in crystalline structures

Computer physics communications, 2021-05, Vol.262, p.107816, Article 107816

2021

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Machine Learning‐Enabled Tomographic Imaging of Chemical Short‐Range Atomic Ordering

Advanced materials (Weinheim), 2024-08, p.e2407564

2024

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A massively parallel semi-Lagrangian solver for the six-dimensional Vlasov–Poisson equation

Octopus, a computational framework for exploring light-driven phenomena and quantum dynamics in extended and finite systems

Efficient all-electron hybrid density functionals for atomistic simulations beyond 10 000 atoms

NECI: N-Electron Configuration Interaction with an emphasis on state-of-the-art stochastic methods

Dnmt2-dependent methylomes lack defined DNA methylation patterns

Quantitative three-dimensional imaging of chemical short-range order via machine learning enhanced atom probe tomography

The genome of the square archaeon Haloquadratum walsbyi : life at the limits of water activity

BioEM: GPU-accelerated computing of Bayesian inference of electron microscopy images

Convolutional neural network-assisted recognition of nanoscale L12 ordered structures in face-centred cubic alloys

Metagenomics to Paleogenomics: Large-Scale Sequencing of Mammoth DNA

Haloquadratum walsbyi: limited diversity in a global pond

Toward Gravitational Wave Signals from Realistic Core-Collapse Supernova Models

nsCouette – A high-performance code for direct numerical simulations of turbulent Taylor–Couette flow

The complete genome sequence of Thermoproteus tenax: a physiologically versatile member of the Crenarchaeota

Validation tests for cryo-EM maps using an independent particle set

Electron Neutrino Pair Annihilation: A New Source for Muon and Tau Neutrinos in Supernovae

Pre-Exascale Computing of Protein–Ligand Binding Free Energies with Open Source Software for Drug Design

Direct recognition of crystal structures via three-dimensional convolutional neural networks with high accuracy and tolerance to random displacements and missing atoms

An efficient particle tracking algorithm for large-scale parallel pseudo-spectral simulations of turbulence

Evaluation of performance portability frameworks for the implementation of a particle‐in‐cell code

3D deep learning for enhanced atom probe tomography analysis of nanoscale microstructures

A blueprint of ectoine metabolism from the genome of the industrial producer Halomonas elongata DSM 2581T

Code modernization strategies for short-range non-bonded molecular dynamics simulations

FaVAD: A software workflow for characterization and visualizing of defects in crystalline structures

Machine Learning‐Enabled Tomographic Imaging of Chemical Short‐Range Atomic Ordering

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