Publications by authors named "ML Klein"

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Age-related Eye Disease Studies Supplements and Genetic Risk Score Are Crucial Determinants of Intestinal Microbial Alterations in Advanced Age-Related Macular Degeneration.
Neda Dadgar, Kevin Fung, Scott McClintic, Christina Metea, Victor Llorenç, Michael L Klein

Ophthalmol Sci· January 2026

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On the origin of hydrophilic interactions at alumina surfaces.
Venkata Surya Kumar Choutipalli, Michael L Klein, Mark DelloStritto

J Chem Phys· November 2025

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Improved loss functions for machine-learned atomic potentials.
Mark DelloStritto, Michael L Klein

J Chem Phys· October 2025

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Design and synthesis of novel small molecules targeting the Kv1.3 voltage-gated potassium ion channel.
Ahmad Abdelwaly, Mohamed A Helal, Marwa M Fathy, Hamdy Alaaeldeen, Michael L Klein

Sci Rep· September 2025

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Microscopic insights into the solvation of polyethylene glycol chains in water: A machine learning potential approach.
Subhajit Acharya, Michael L Klein, Mark DelloStritto

J Chem Phys· August 2025

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Plant secondary metabolites in beef cattle diets affect reactive nitrogen and greenhouse gas emissions during manure soil application: A laboratory incubation.
Matthew L Klein, Xia Zhu-Barker, Sebastian E Mejia Turcios, William R Horwath, Frank M Mitloehner

Sci Total Environ· June 2025

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Honoring Prof. William (Bill) F. DeGrado: An Inspiring Journey of a Transformative Chemist.
Marcos Piers, Michael L Klein, Jayanta Haldar

ACS Infect Dis· June 2025

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Limited effects of tannin supplementation on the dairy cattle fecal microbiome with modulation of metabolites.
Matthew L Klein, Christian B Erikson, Conor J McCabe, Laibin Huang, Jorge L Mazza Rodrigues

Front Microbiol· June 2025

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Quantitative insights into the efficacy of genome-resolved surveys of microbial communities through ribosomal protein phylogeography and EcoPhylo.
Matthew S Schechter, Florian Trigodet, Iva A Veseli, Samuel E Miller, Matthew L Klein

bioRxiv· April 2025

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On the role of α-alumina in the origin of life: Surface-driven assembly of amino acids.
Ruiyu Wang, Richard C Remsing, Michael L Klein, Eric Borguet, Vincenzo Carnevale

Sci Adv· April 2025

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Molecular dynamics studies of knotted polymers.
Mark DelloStritto, Cristian Micheletti, Michael L Klein

J Chem Phys· December 2024

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Understanding Strain and Failure of a Knot in Polyethylene Using Molecular Dynamics with Machine-Learned Potentials.
Mark DelloStritto, Michael L Klein

J Phys Chem Lett· September 2024

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Proton Transport Scenarios in Sulfuric Acid Explored via Ab Initio Molecular Dynamics Simulations.
Suleman Jalilahmad Ansari, Sipra Mohapatra, Giacomo Fiorin, Michael L Klein, Santosh Mogurampelly

J Phys Chem B· September 2024

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Glycan-Driven Formation of Raft-Like Domains with Hierarchical Periodic Nanoarrays on Dendrimersome Synthetic Cells.
Anna M Wagner, Nina Yu Kostina, Qi Xiao, Michael L Klein, Virgil Percec

Biomacromolecules· January 2024

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Understanding the Anomalous Diffusion of Water in Aqueous Electrolytes Using Machine Learned Potentials.
Nikhil V S Avula, Michael L Klein, Sundaram Balasubramanian

J Phys Chem Lett· October 2023

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Why Dissolving Salt in Water Decreases Its Dielectric Permittivity.
Chunyi Zhang, Shuwen Yue, Athanassios Z Panagiotopoulos, Michael L Klein, Xifan Wu

Phys Rev Lett· August 2023

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Molecular Engineering of pH-Responsive Anchoring Systems onto Poly(ethylene glycol) Corona.
Shaohua Zhang, Abhinav Srivastava, Wei Li, Sjoerd J Rijpkema, Vincenzo Carnevale, Michael L Klein

J Am Chem Soc· May 2023

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Ultra-rare complement factor 8 coding variants in families with age-related macular degeneration.
Lina Zelinger, Tammy M Martin, Jayshree Advani, Laura Campello, Milton A English, Michael L Klein

iScience· April 2023

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Adaptive insertion of a hydrophobic anchor into a poly(ethylene glycol) host for programmable surface functionalization.
Shaohua Zhang, Wei Li, Jiabin Luan, Abhinav Srivastava, Vincenzo Carnevale, Michael L Klein

Nat Chem· February 2023

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Probing the Gold/Water Interface with Surface-Specific Spectroscopy.
Stefan M Piontek, Dennis Naujoks, Tadneem Tabassum, Mark J DelloStritto, Maximilian Jaugstetter, Michael L Klein

ACS Phys Chem Au· January 2023

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Superhydrophilicity of α-alumina surfaces results from tight binding of interfacial waters to specific aluminols.
Ruiyu Wang, Yunqian Zou, Richard C Remsing, Naomi O Ross, Michael L Klein

J Colloid Interface Sci· December 2022

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Understanding the Dynamics of the Structural States of Cannabinoid Receptors and the Role of Different Modulators.
Anjela Manandhar, Mona H Haron, Michael L Klein, Khaled Elokely

Life (Basel)· December 2022

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Allosteric inhibitors of the main protease of SARS-CoV-2.
Subodh Kumar Samrat, Jimin Xu, Xuping Xie, Eleonora Gianti, Haiying Chen, Michael L Klein

Antiviral Res· September 2022

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SPICA Force Field for Proteins and Peptides.
Shuhei Kawamoto, Huihui Liu, Yusuke Miyazaki, Sangjae Seo, Mayank Dixit, Michael L Klein

J Chem Theory Comput· May 2022

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Potential Pro-Inflammatory Effect of Vitamin E Analogs through Mitigation of Tetrahydrocannabinol (THC) Binding to the Cannabinoid 2 Receptor.
Anjela Manandhar, Mona H Haron, Samir A Ross, Michael L Klein, Khaled M Elokely

Int J Mol Sci· April 2022

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