Collection
MIB 2017 (Modeling Interactions in Biomolecules VIII)
- Submission status
- Closed
Guest edited by Jaroslav Burda
Editors
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Jaroslav Burda
Jaroslav Burda is a Professor at the Department of Chemical Physics, Faculty of Mathematics and Physics, Charles University in Prague. His reasearch interest is in QM study of metal ions interactions with biomolecules. He has published more than 100 original scientific papers with over 3100 citation response.
Articles (7 in this collection)
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Application of a computational model of natural deep eutectic solvents utilizing the COSMO-RS approach for screening of solvents with high solubility of rutin
Authors
- Tomasz Jeliński
- Piotr Cysewski
- Content type: Original Paper
- Open Access
- Published: 27 June 2018
- Article: 180
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A residue of motif III positions the helicase domains of motor subunit HsdR in restriction-modification enzyme EcoR124I
Authors (first, second and last of 11)
- Dhiraj Sinha
- Vitali Bialevich
- Rüdiger Ettrich
- Content type: Original Paper
- Published: 26 June 2018
- Article: 176
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On bond-critical points in QTAIM and weak interactions
Authors
- Christian R. Wick
- Timothy Clark
- Content type: Original Paper
- Published: 31 May 2018
- Article: 142
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Hydroxamic acid derivatives as histone deacetylase inhibitors: a DFT study of their tautomerism and metal affinities/selectivities
Authors (first, second and last of 5)
- D. Cheshmedzhieva
- N. Toshev
- T. Dudev
- Content type: Original Paper
- Published: 24 April 2018
- Article: 114
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Intermolecular interaction as a direct measure of water solubility advantage of meloxicam cocrystalized with carboxylic acids
Authors
- Piotr Cysewski
- Content type: Original Paper
- Open Access
- Published: 21 April 2018
- Article: 112
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Competition between abiogenic Al3+ and native Mg2+, Fe2+ and Zn2+ ions in protein binding sites: implications for aluminum toxicity
Authors
- Todor Dudev
- Diana Cheshmedzhieva
- Lyudmila Doudeva
- Content type: Original Paper
- Published: 14 February 2018
- Article: 55