Emad Tajkhorshid

Professor of Biochemistry, Chemistry, Biophysics, Bioengineering, and Computational Science and Engineering

University of Illinois at Urbana-Champaign

United States

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About

Emad Tajkhorshid is a Professor of Biochemistry, Chemistry, Biophysics, Bioengineering, and Computational Science and Engineering at the University of Illinois at Urbana-Champaign, USA. His research focuses on molecular dynamics simulations, particularly in understanding membrane transport mechanisms and interactions at the molecular level. Recent publications include studies on serotonin transport, allosteric mechanisms in protein complexes, and advanced simulation techniques for biological membranes.

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Collaborators (14)

Aditi Das

UNITED STATES

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Nicholas Jackson

Assistant Professor

University of Illinois at Urbana-Champaign

UNITED STATES

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Benoît Roux

University of Chicago

UNITED STATES

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Jeffrey Moore

Professor

University of Illinois at Urbana-Champaign

UNITED STATES

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Hee Jung Chung

Associate Professor

University of Illinois at Urbana-Champaign

UNITED STATES

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Sepehr Dehghani Ghahnaviyeh

Beckman Institute for Advanced Science and Technology

UNITED STATES

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Nicola Pozzi

Associate Professor

Saint Louis University

UNITED STATES

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Shan Zhou

Assistant Professor

South Dakota School of Mines and Technology

UNITED STATES

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James Morrissey

University of Michigan

UNITED STATES

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Charles M. Schroeder

UNITED STATES

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David Sarlah

ITALY

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Sean Fanning

Assistant Professor

Loyola University Chicago

UNITED STATES

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Ziqiao Ding

University of Illinois at Urbana-Champaign

UNITED STATES

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David Sherrill

Professor

Georgia Institute of Technology

UNITED STATES

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Emad Tajkhorshid

Research Interests

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About

Articles (30)

Cryo-EM structure of the tissue factor/factor VIIa complex with a factor X mimetic reveals a novel allosteric mechanism.

Dissecting Large-Scale Structural Transitions in Membrane Transporters Using Advanced Simulation Technologies

The String Method with Swarms of Trajectories: A Tutorial for Free-Energy Calculations Along a Zero-Drift Pathway

An Orchestrated Interaction Network at the Binding Site of Human SERT Enables the Serotonin Occlusion and Import

Ca2+ Stoichiometry Controls the Binding Mode of the PKCα C2 Domain to Anionic Membranes

Voltage sensor conformations induced by LQTS-associated mutations in hERG potassium channels

Molecular dynamics simulations of biological membranes and membrane-associated phenomena across scales

Amino Acid Sequence Controls Enhanced Electron Transport in Heme-Binding Peptide Monolayers

Restricted Surface Diffusion of Cytochromes on Bioenergetic Membranes with Anionic Lipids

Conformational free energy landscape of a glutamate transporter and microscopic details of its transport mechanism

Elucidating the Mechanism of Metabolism of Cannabichromene by Human Cytochrome P450s

Structure of the human dopamine transporter and mechanisms of inhibition

Secondary structure determines electron transport in peptides

GOLEM: Automated and Robust Cryo-EM-Guided Ligand Docking with Explicit Water Molecules

Topological Learning Approach to Characterizing Biological Membranes

Atomistic characterization of β2-glycoprotein I domain V interaction with anionic membranes

Broadening access to small-molecule parameterization with the force field toolkit

Improved Highly Mobile Membrane Mimetic Model for Investigating Protein–Cholesterol Interactions

A Gram-negative-selective antibiotic that spares the gut microbiome

Beyond nothingness in the formation and functional relevance of voids in polymer films

PIP2-dependent coupling of voltage sensor and pore domains in Kv7.2 channel

Differential Interactions of Selected Phytocannabinoids with Human CYP2D6 Polymorphisms

Molecular mechanism of capsid disassembly in hepatitis B virus

Defining the Energetic Basis for a Conformational Switch Mediating Ligand-Independent Activation of Mutant Estrogen Receptors in Breast Cancer

Molecular mechanism of prestin electromotive signal amplification

Cryo-EM structures of Escherichia coli cytochrome bo 3 reveal bound phospholipids and ubiquinone-8 in a dynamic substrate binding site

Amphiphilic Distyrylbenzene Derivatives as Potential Therapeutic and Imaging Agents for Soluble and Insoluble Amyloid β Aggregates in Alzheimer’s Disease

Binding mode of SARS-CoV-2 fusion peptide to human cellular membrane

Structural basis of complex formation between mitochondrial anion channel VDAC1 and Hexokinase-II

Mechanical properties of ester- and ether-DPhPC bilayers: A molecular dynamics study

Collaborators (14)

Aditi Das

Nicholas Jackson

Benoît Roux

Jeffrey Moore

Hee Jung Chung

Sepehr Dehghani Ghahnaviyeh

Nicola Pozzi

Shan Zhou

James Morrissey

Charles M. Schroeder

David Sarlah

Sean Fanning

Ziqiao Ding

David Sherrill

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