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Publications by Octav Caldararu
Protonation States of Homocitrate and Nearby Residues in Nitrogenase Studied by Computational Methods and Quantum Refinement
Journal of Physical Chemistry B
Surfaces
Theoretical Chemistry
Materials Chemistry
Films
Medicine
Coatings
Physical
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Protonation and Reduction of the FeMo Cluster in Nitrogenase Studied by Quantum Mechanics/Molecular Mechanics (QM/MM) Calculations
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Probing Structural States in Fast Exchanging Proteins by FRET and Computational Methods
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Ligand Protonation States and Stereoisomers in Virtual Screening
Chemistry Central Journal
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The Determination of Protonation States in Proteins
Acta Crystallographica Section A Foundations of Crystallography
The Role of Protonation States in Ligand-Receptor Recognition and Binding
Current Pharmaceutical Design
Drug Discovery
Pharmacology
Dehydrohalogenation and Dehydration Reactions Ofi-C3H7Br Andi-C3h7oh by Sodium Ions Studied by Guided Ion Beam Techniques and Quantum Chemical Methods
Journal of Physical Chemistry A
Medicine
Theoretical Chemistry
Physical
A Major Structural Change of the Homocitrate Ligand of Probable Importance for the Nitrogenase Mechanism
Antidepressant Drug-Protein Interactions Studied by Spectroscopic Methods Based on Fluorescent Carbon Quantum Dots
Heliyon
Multidisciplinary
