M. Hanwell

发表

First Year Report: Structural Properties of Metal-Organic Nanosystems for Sensing Applications

M. Hanwell, 2004 .

Non-collinear ferrimagnetism in a Fe64Er19B17 metallic glass

A. Wildes, M. Hanwell, N. Cowlam, 2010, Journal of physics. Condensed matter : an Institute of Physics journal.

Temperature effects on the electrical conductivity of thiol encapsulated gold nanoparticle thin films

T. Richardson, M. Hanwell, N. J. Hardy, 2007 .

Open Chemistry, JupyterLab , REST , and quantum chemistry

Mojtaba Haghighatlari, J. Hachmann, W. D. Jong, 2021 .

Evidence of collinear ferrimagnetism in (Fe, Tb)B metallic glasses from polarized beam neutron scattering

A. Wildes, M. Hanwell, N. Cowlam, 2005 .

Real-time 3D analysis during electron tomography using tomviz

Huihuo Zheng, Berk Geveci, P. Ercius, 2022, Nature Communications.

Real-Time 3D Analysis During Tomographic Experiments using tomviz

Berk Geveci, P. Ercius, Utkarsh Ayachit, 2022 .

gromacs: local virial implementation of PME electrostatics

Kyle A. Beauchamp, John D. Eblen, J. Hammond, 2016 .

Tomviz: Open Source Platform Connecting Image Processing Pipelines to GPU Accelerated 3D Visualization

M. Hanwell, R. Hovden, Yi Jiang, 2019, Microscopy and Microanalysis.

Avogadro: an advanced semantic chemical editor, visualization, and analysis platform

Marcus D. Hanwell, David C. Lonie, Eva Zurek, 2012, Journal of Cheminformatics.

Photochemical fabrication of three-dimensional micro- and nano-structured surfaces from a C60 monoadduct

Shuqing Sun, T. Richardson, D. Tunnicliffe, 2008 .

Tutorial on the Visualization of Volumetric Data Using tomviz

Yi Jiang, Marcus D. Hanwell, Utkarsh Ayachit, 2018, Microscopy Today.

Dynamic Compressed Sensing for Real-time Tomographic Reconstruction

M. Hanwell, Huihuo Zheng, R. Hovden, 2020, Microscopy and Microanalysis.

Delivering real-time multi-modal materials analysis with enterprise beamlines

Phillip M. Maffettone, M. Hanwell, D. Olds, 2022, Cell Reports Physical Science.

Advancing Discovery with Artificial Intelligence and Machine Learning at NSLS-II

Phillip M. Maffettone, M. Fukuto, M. Hanwell, 2022, Synchrotron Radiation News.

Self-driving Multimodal Studies at User Facilities

Brian L. DeCost, Matthew R. Carbone, Phillip M. Maffettone, 2023, Acta Crystallographica Section A Foundations and Advances.

The Quixote project: Collaborative and Open Quantum Chemistry data management in the Internet age

Peter Murray-Rust, Pablo de Castro, Samuel E. Adams, 2011, J. Cheminformatics.

The 4D Camera – An 87 kHz Frame-rate Detector for Counted 4D-STEM Experiments

Patrick Avery, Colin Ophus, John Joseph, 2020, Microscopy and Microanalysis.

Summary of the First Workshop on Sustainable Software for Science: Practice and Experiences (WSSSPE1) pdf

Nancy Wilkins-Diehr, Daniel S. Katz, James Howison, 2014, ArXiv.

Open Chemistry, JupyterLab , REST , and quantum chemistry

Mojtaba Haghighatlari, J. Hachmann, M. Hanwell, 2020, International Journal of Quantum Chemistry.

Open Data, Open Source and Open Standards in chemistry: The Blue Obelisk five years on

Igor V. Filippov, Egon L. Willighagen, Ola Spjuth, 2011, J. Cheminformatics.

Fabrication of gold micro- and nanostructures by photolithographic exposure of thiol-stabilized gold nanoparticles.

S. Evans, Shuqing Sun, T. Richardson, 2006, Nano letters (Print).

Practicing Open Science

William J. Schroeder, Marcus D. Hanwell, Luis Ibanez, 2018, Implementing Reproducible Research.

A hybrid visualization system for molecular models

Charles Marion, Joachim Pouderoux, Julien Jomier, 2013, Web3D '13.

From data to analysis: linking NWChem and Avogadro with the syntax and semantics of Chemical Markup Language

Marcus D. Hanwell, Andrew M. Walker, Wibe A. de Jong, 2013, Journal of Cheminformatics.

The Visualization Toolkit (VTK): Rewriting the rendering code for modern graphics cards

Aashish Chaudhary, Marcus D. Hanwell, Lisa Avila, 2015 .

Gas and vapour sensing characteristics of Langmuir-Schaeffer thiol encapsulated gold nanoparticle thin films

Marcus D. Hanwell, Tim H. Richardson, Ian M. Ross, 2006 .

Cross-Platform Ubiquitous Volume Rendering Using Programmable Shaders in VTK for Scientific and Medical Visualization

Aashish Chaudhary, William J. Schroeder, Marcus D. Hanwell, 2019, IEEE Computer Graphics and Applications.

Open chemistry: RESTful web APIs, JSON, NWChem and the modern web application

Marcus D. Hanwell, Christopher J. Harris, Wibe A. de Jong, 2017, Journal of Cheminformatics.