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Munir Skaf

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Full Professor

University of Campinas

Brazil

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Professors in Molecular Dynamics

Recent Grants

Grant: Close

Centro de Pesquisa em Engenharia e Ciências Computacionais

Open Date: 2013-06-01

Close Date: 2018-05-01

Articles (12)

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2026

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2025

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2025

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2025

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2025

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2024

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2024

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2024

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2024

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2023

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2023

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2023

Collaborators (6)

Markus Buehler

Massachusetts Institute of Technology

UNITED STATES

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Mario Milazzo

Senior Assistant Professor

University of Pisa

ITALY

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Guy M. Genin

Washington University in St. Louis

UNITED STATES

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Vicent Moliner

Universitat Jaume I

SPAIN

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Marc Ostermeier

Professor

Johns Hopkins University

UNITED STATES

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Jeffrey Gray

Professor

Johns Hopkins University

UNITED STATES

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Munir Skaf

Research Interests

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Recent Grants

Articles (12)

Molecular Dynamics Insights into the Biodegradation of Synthetic Polymers by Moniliophthora roreri Cutinases

Molecular-Scale Interactions at Mineralized Collagen Interfaces Prevent Network Percolation, Preserving Compliance

Conformational Dynamics and Binding Interactions of SARS-CoV-2 Spike Protein Variants: Omicron, XBB.1.9.2, and EG.5

Computational Insights into Glucose Tolerance and Stimulation in a Family 1 β-glucosidase

Unraveling the Mechanical Behavior of Softwood Secondary Cell Walls through Atomistic Simulations

Thermostability Enhancement of GH 62 α-l-Arabinofuranosidase by Directed Evolution and Rational Design

Exploring the Structural and Dynamic Properties of a Chimeric Glycoside Hydrolase Protein in the Presence of Calcium Ions

Exploring the Reaction Mechanism of Polyethylene Terephthalate Biodegradation through QM/MM Approach

Crosslinker energy landscape effects on dynamic mechanical properties of ideal polymer hydrogels

MassCCS: A High-Performance Collision Cross-Section Software for Large Macromolecular Assemblies

Biotransformation of Bisphenol by Human Cytochrome P450 2C9 Enzymes: A Density Functional Theory Study

The Role of the Extrafibrillar Volume on the Mechanical Properties of Molecular Models of Mineralized Bone Microfibrils

Collaborators (6)

Markus Buehler

Mario Milazzo

Guy M. Genin

Vicent Moliner

Marc Ostermeier

Jeffrey Gray

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