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Publications by Eva Pluhařová
Peptide Salt Bridge Stability: From Gas Phase via Microhydration to Bulk Water Simulations
Journal of Chemical Physics
Medicine
Theoretical Chemistry
Astronomy
Physics
Physical
Coupled Valence-Bond State Molecular Dynamics Description of an Enzyme-Catalyzed Reaction in a Non-Aqueous Organic Solvent
Journal of Physical Chemistry B
Surfaces
Theoretical Chemistry
Materials Chemistry
Films
Medicine
Coatings
Physical
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Water-Assisted Peptide Bond Formation Between Two Double Amino Acid Molecules in the Gas Phase
Journal of Molecular Modeling
Organic Chemistry
Theoretical Chemistry
Inorganic Chemistry
Computer Science Applications
Mathematics
Computational Theory
Catalysis
Physical
Complete Sampling of an Enzyme Reaction Pathway: A Lesson From Gas Phase Simulations
RSC Advances
Chemistry
Chemical Engineering
Cavern Roof Stability for Natural Gas Storage in Bedded Salt
Colossal Stability of Gas-Phase Trianions: Super-Pnictogens
Angewandte Chemie - International Edition
Catalysis
Chemistry
Colossal Stability of Gas-Phase Trianions: Super-Pnictogens
Angewandte Chemie
Compression-Induced Phase Transition of GaN Bulk From Wurtzite Phase to Five-Fold Coordination Hexagonal Phase
AIP Advances
Nanotechnology
Astronomy
Physics
Nanoscience
Infrared Spectroscopy in the Gas and Liquid Phase From First Principle Molecular Dynamics Simulations: Application to Small Peptides
Molecular Physics
Theoretical Chemistry
Biophysics
Condensed Matter Physics
Molecular Biology
Physical
Relationship Between Ca2+-Affinity and Shielding of Bulk Water in the Ca2+-Pump From Molecular Dynamics Simulations
Proceedings of the National Academy of Sciences of the United States of America
Multidisciplinary
Effects of Temperature and Salt Concentration on the Structural Stability of Human Lymphotactin: Insights From Molecular Simulations