Advertisement

Browse Subject Areas

?

Click through the PLOS taxonomy to find articles in your field.

For more information about PLOS Subject Areas, click here.

Molecular dynamics

Unveiling the Mechanism of Arginine Transport through AdiC with Molecular Dynamics Simulations: The Guiding Role of Aromatic Residues

Eva-Maria Krammer, Kassem Ghaddar, Bruno André, Martine Prévost

Insight on Mutation-Induced Resistance from Molecular Dynamics Simulations of the Native and Mutated CSF-1R and KIT

Priscila Da Silva Figueiredo Celestino Gomes, Isaure Chauvot De Beauchêne, [ ... ], Luba Tchertanov

Computational Study of the Binding Mechanism of Actin-Depolymerizing Factor 1 with Actin in Arabidopsis thaliana

Juan Du, Xue Wang, [ ... ], Xiao Jun Yao

Amyotrophic Lateral Sclerosis Type 20 - In Silico Analysis and Molecular Dynamics Simulation of hnRNPA1

Bruna Baumgarten Krebs, Joelma Freire De Mesquita

Common Internal Allosteric Network Links Anesthetic Binding Sites in a Pentameric Ligand-Gated Ion Channel

Thomas T. Joseph, Joshua S. Mincer

Membrane Mediated Antimicrobial and Antitumor Activity of Cathelicidin 6: Structural Insights from Molecular Dynamics Simulation on Multi-Microsecond Scale

Bikash Ranjan Sahoo, Toshimichi Fujiwara

Molecular Dynamics Driven Design of pH-Stabilized Mutants of MNEI, a Sweet Protein

Serena Leone, Delia Picone

Identification of a 3^rd Na⁺ Binding Site of the Glycine Transporter, GlyT2

Nandhitha Subramanian, Amanda J. Scopelitti, [ ... ], Robert J. Vandenberg

Redesigning Aldolase Stereoselectivity by Homologous Grafting

Carolin Bisterfeld, Thomas Classen, [ ... ], Jörg Pietruszka

Cloning and Expression of β-Defensin from Soiny Mullet (Liza haematocheila), with Insights of its Antibacterial Mechanism

Zhitao Qi, Wei Xu, [ ... ], Rong Shao

Examining the Conservation of Kinks in Alpha Helices

Eleanor C. Law, Henry R. Wilman, [ ... ], Charlotte M. Deane

Molecular Dynamics Simulations and Structural Analysis to Decipher Functional Impact of a Twenty Residue Insert in the Ternary Complex of Mus musculus TdT Isoform

Eshita Mutt, Ramanathan Sowdhamini

Threonine 89 Is an Important Residue of Profilin-1 That Is Phosphorylatable by Protein Kinase A

David Gau, William Veon, [ ... ], Partha Roy

Advertisement

Create a weekly email alert for: Molecular dynamics

You can change these options by clicking profile then "Alerts and Notifications"