Computational Chemistry
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- 2020
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Mark
Spontaneous Formation of Cushioned Model Membranes Promoted by an Intrinsically Disordered Protein
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- Contribution to journal › Article
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Mark
Physicochemical characterisation of KEIF€-the intrinsically disordered N-terminal region of magnesium transporter A
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- Contribution to journal › Article
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Mark
An Exact Ewald Summation Method in Theory and Practice
2020) In The Journal of Physical Chemistry Part A: Molecules, Spectroscopy, Kinetics, Environment and General Theory 124(19). p.3943-3946(
- Contribution to journal › Article
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Mark
Non-radiative decay and fragmentation in water molecules after 1a1-14a1 excitation and core ionization studied by electron-energy-resolved electron-ion coincidence spectroscopy
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- Contribution to journal › Article
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Mark
Phosphorylation of a Disordered Peptide - Structural Effects and Force Field Inconsistencies
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- Contribution to journal › Article
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Mark
Integrating All-Atom and Coarse-Grained Simulations - Toward Understanding of IDPs at Surfaces
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- Contribution to journal › Article
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Mark
Coarse-Grained Modelling of Protein Adsorption
2020)(
- Thesis › Doctoral thesis (compilation)
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Mark
N2H2 binding to the nitrogenase FeMo cluster studied by QM/MM methods
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- Contribution to journal › Article
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Mark
Adsorption of Fibrinogen on Silica Surfaces-The Effect of Attached Nanoparticles
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- Contribution to journal › Article
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Mark
Photophysics and photochemistry of iron carbene complexes for solar energy conversion and photocatalysis
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- Contribution to journal › Scientific review