Computational Chemistry
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- 2021
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Mark
Virtual cell model for osmotic pressure calculation of charged biomolecules
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- Contribution to journal › Article
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Mark
Neutron structures of Leishmania mexicana triosephosphate isomerase in complex with reaction-intermediate mimics shed light on the proton-shuttling steps
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- Contribution to journal › Article
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Mark
Norske bjørnebær 6. Sørlandsbjørnebær Rubus ”firmus”
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- Contribution to journal › Article
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Mark
Can the results of quantum refinement be improved with a continuum-solvation model?
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- Contribution to journal › Article
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Mark
Self-Diffusive Properties of the Intrinsically Disordered Protein Histatin 5 and the Impact of Crowding Thereon : A Combined Neutron Spectroscopy and Molecular Dynamics Simulation Study
2021) In Journal of Physical Chemistry B(
- Contribution to journal › Article
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Mark
Exploring ligand dynamics in protein crystal structures with ensemble refinement
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- Contribution to journal › Article
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Mark
Modelling Biomolecular Interactions of Protein Solutions : Combining Theories and Experiments
2021)(
- Thesis › Doctoral thesis (compilation)
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Mark
PED in 2021 : A major update of the protein ensemble database for intrinsically disordered proteins
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- Contribution to journal › Article
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Mark
Molecular dynamics simulations of phosphorylated intrinsically disordered proteins : A force field comparison
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- Contribution to journal › Article
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Mark
Comparison of the accuracy of DFT methods for reactions with relevance to nitrogenase
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- Contribution to journal › Article