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Research article

First published 2001-12

A review on the molecular dynamics simulation of machining at the atomic scale

R Komanduri, L M Raff

Proceedings of the Institution of Mechanical Engineers,Part B: Journal of Engineering Manufacture

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Research article

First published 2023-12

Research on the effect of cutting parameters on the machinability of polycrystalline Fe-Cr-W alloy by molecular dynamics simulation

Tianwen Zhou, Qingtang Wu, Jianwei Che [...]

Proceedings of the Institution of Mechanical Engineers,Part B: Journal of Engineering Manufacture

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Research article

First published 2018

Cross-cancer Prediction: A Novel Machine Learning Approach to Discover Molecular Targets for Development of Treatments for Multiple Cancers

Katie Gao, Dayong Wang, Yi Huang

Cancer Informatics

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Research article

First published 2019-1

Molecular dynamics simulation of machining properties of polycrystalline copper in electrical discharge machining

Xiaoming Yue, Xiaodong Yang

Proceedings of the Institution of Mechanical Engineers,Part B: Journal of Engineering Manufacture

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Research article

First published 2024-7

Machine Learning-Assisted Determination of C 6 H 14 Mole Fraction From Molecular Emissions of Laser-Induced Hexane–Air Plasmas

Ashwin P. Rao, Noshin Nawar, Christopher J. Annesley

Applied Spectroscopy

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Other

First published 2016-12

The 2016 Nobel Prize for Chemistry,Awarded for: “The Design and Synthesis of Molecular Machines”

Christopher J. Rhodes

Science Progress

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Research article

First published 2025-05

Compressed Representation of Extreme Learning Machine with Self-Diffusion Graph Denoising Applied for Dissecting Molecular Heterogeneity

Xin Duan, Xinnan Ding, Yuelin Lu

Journal of Computational Biology

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Research article

First published 2018-5

Molecular dynamics simulation of the elliptical vibration-assisted machining of pure iron

Saurav Goel, Fabian Duarte Martinez, Saeed Zare Chavoshi [...]

Journal of Micromanufacturing

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Research article

First published 2023-07

A Robust Machine Learning Framework Built Upon Molecular Representations Predicts CYP450 Inhibition: Toward Precision in Drug Repurposing

Sotiris Ouzounis, Vasilis Panagiotopoulos, Vivi Bafiti [...]

OMICS: A Journal of Integrative Biology

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Research article

First published 2020-7

Model-driven design of bioactive glasses: from molecular dynamics through machine learning

Maziar Montazerian, Edgar D. Zanotto, John C. Mauro

International Materials Reviews

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