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pH molecular-dynamics
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Molecular Dynamics Simulations of RNA Polymerases
2007 |
Faculty of Mathematics and Physics
publication
Computational Procedures in Molecular Dynamics
2012 |
Faculty of Mathematics and Physics
publication
Processes in nanostructures si mulated by molecular dynamics
2023 |
Faculty of Mathematics and Physics
publication
Homology Modeling and Molecular Dynamics Simulations of RNA Polymerases
+2
2007 |
Faculty of Mathematics and Physics
publication
Molecular dynamics simulations of a polyelectrolyte star in poor solvent
2010 |
Faculty of Science
publication
E. Coli RNase HI and the Phosphonate-DNA/RNA Hybrid: Molecular Dynamics Simulations
2005 |
Faculty of Mathematics and Physics
publication
Molecular Dynamics with Helical Periodic Boundary Conditions
2014 |
Faculty of Science
publication
AL nanocrystalline thin film deformation by in situ TEM and molecular dynamics
2022 |
Faculty of Mathematics and Physics
publication
Cationic Phosphoramidate a-oligonucleotides Target Double Stranded DNA: Molecular Dynamics Study
2005 |
Faculty of Mathematics and Physics
publication
Deformation mechanisms of Al thin films: In-situ TEM and molecular dynamics study
2022 |
Faculty of Mathematics and Physics
publication
Mechanical and thermal properties of graphene random nanofoams via Molecular Dynamics simulations
2018 |
Faculty of Mathematics and Physics
publication
Effect O6-Guanine Alkylation on DNA Flexibility Studied by Comparative Molecular Dynamics Simulations
2015 |
Faculty of Science
publication
Parallel variable selection of molecular dynamics clusters as a tool for calculation of spectroscopic properties
2013 |
Faculty of Science, Central Library of Charles University
publication
Arrangement of Fibril Side Chains Studied by Molecular Dynamics and Simulated Infrared and Vibrational Circular Dichroism Spectra
2014 |
Faculty of Science
publication
Substrate recognition by norovirus polymerase: microsecond molecular dynamics study
2013 |
Faculty of Mathematics and Physics
publication
Quasi-Particle Approach to 2D IR Spectra of Vibrational Excitons in Biomolecules; Molecular Dynamics versus Stochastic Simulation Protocols
2013 |
Faculty of Mathematics and Physics
publication
Structure of Zinc and Nickel Histidine Complexes in Solution Revealed by Molecular Dynamics and Raman Optical Activity
2022 |
Faculty of Mathematics and Physics
publication
Complex between Human RNase HI and the phosphonate-DNA/RNA duplex: Molecular dynamics study
2013 |
Faculty of Mathematics and Physics
publication
Molecular dynamics and Raman optical activity spectra reveal nucleotide conformation ratios in solution
2023 |
Faculty of Mathematics and Physics
publication
Recognition of 2 ',5 '-linked oligoadenylates by human ribonuclease L: molecular dynamics study
2014 |
Faculty of Mathematics and Physics
publication
Orientation of Laurdan in Phospholipid Bilayers Influences Its Fluorescence: Quantum Mechanics and Classical Molecular Dynamics Study
2018 |
Faculty of Science, Central Library of Charles University
publication
Functionalization of the Parylene C Surface Enhances the Nucleation of Calcium Phosphate: Combined Experimental and Molecular Dynamics Simulations Approach
2020 |
Faculty of Science, Central Library of Charles University
publication
Role of the Molecular Environment in Quenching the Irradiation-Driven Fragmentation of Fe(CO)5: A Reactive Molecular Dynamics Study
2023 |
Faculty of Mathematics and Physics
publication
Flexible docking-based molecular dynamics/steered molecular dynamics calculations of protein-protein contacts in a complex of cytochrome P450 1A2 with cytochrome b5
2014 |
Faculty of Science
publication
Characterisation of Explosive Materials Using Molecular Dynamics Simulations
2003 |
Faculty of Mathematics and Physics
publication
Characterization of explosive materials using molecular dynamics simulations
2002 |
Publication without faculty affiliation
publication
Molecular dynamics simulation and binding free energy studies of novel leads belonging to the benzofuran class inhibitors of Mycobacterium tuberculosis Polyketide Synthase 13
2019 |
Publication without faculty affiliation
publication
Time-resolved fluorescence spectroscopy and molecular dynamics simulations point out the effects of pressure on the stability and dynamics of the porcine odorant-binding protein
2008 |
Faculty of Mathematics and Physics