Protein 3D Hydration: A Case of Bovine Pancreatic Trypsin Inhibitor
Kruchinin, Sergey E, Kislinskaya, Ekaterina E, Chuev, Gennady N, Fedotova, Marina V
Published in International journal of molecular sciences (26.11.2022)
Published in International journal of molecular sciences (26.11.2022)
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Journal Article
Site Density Functional Theory and Structural Bioinformatics Analysis of the SARS-CoV Spike Protein and hACE2 Complex
Kumawat, Nitesh, Tucs, Andrejs, Bera, Soumen, Chuev, Gennady N, Valiev, Marat, Fedotova, Marina V, Kruchinin, Sergey E, Tsuda, Koji, Sljoka, Adnan, Chakraborty, Amit
Published in Molecules (Basel, Switzerland) (26.01.2022)
Published in Molecules (Basel, Switzerland) (26.01.2022)
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Journal Article
Cation-Binding of Glutamate in Aqueous Solution
Friesen, Sergej, Kruchinin, Sergey E., Fedotova, Marina V., Buchner, Richard
Published in The journal of physical chemistry. B (13.06.2024)
Published in The journal of physical chemistry. B (13.06.2024)
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Journal Article
Ion Pairing of the Neurotransmitters Acetylcholine and Glutamate in Aqueous Solutions
Kruchinin, Sergey E, Fedotova, Marina V
Published in The journal of physical chemistry. B (14.10.2021)
Published in The journal of physical chemistry. B (14.10.2021)
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Journal Article
Hydration and dynamics of L-glutamate ion in aqueous solution
Friesen, Sergej, Fedotova, Marina V, Kruchinin, Sergey E, Buchner, Richard
Published in Physical chemistry chemical physics : PCCP (21.01.2021)
Published in Physical chemistry chemical physics : PCCP (21.01.2021)
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Journal Article
Hydration and Ion Binding of the Osmolyte Ectoine
Eiberweiser, Andreas, Nazet, Andreas, Kruchinin, Sergey E, Fedotova, Marina V, Buchner, Richard
Published in The journal of physical chemistry. B (10.12.2015)
Published in The journal of physical chemistry. B (10.12.2015)
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Journal Article
Renormalized site density functional theory
Chuev, Gennady N, Fedotova, Marina V, Valiev, Marat
Published in Journal of statistical mechanics (01.03.2021)
Published in Journal of statistical mechanics (01.03.2021)
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Journal Article
Hydration and counterion binding of aqueous acetylcholine chloride and carbamoylcholine chloride
Friesen, Sergej, Fedotova, Marina V, Kruchinin, Sergey E, Bešter-Roga, Marija, Podlipnik, rtomir, Buchner, Richard
Published in Physical chemistry chemical physics : PCCP (17.11.2021)
Published in Physical chemistry chemical physics : PCCP (17.11.2021)
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