Water inside β-cyclodextrin cavity: amount, stability and mechanism of binding
Pereva, Stiliyana, Nikolova, Valya, Angelova, Silvia, Spassov, Tony, Dudev, Todor
Published in Beilstein journal of organic chemistry (17.07.2019)
Published in Beilstein journal of organic chemistry (17.07.2019)
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Carbonic Anhydrases: Different Active Sites, Same Metal Selectivity Rules
Kircheva, Nikoleta, Angelova, Silvia, Dudev, Todor
Published in Molecules (Basel, Switzerland) (26.04.2024)
Published in Molecules (Basel, Switzerland) (26.04.2024)
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Lanthanides as Calcium Mimetic Species in Calcium-Signaling/Buffering Proteins: The Effect of Lanthanide Type on the Ca2+/Ln3+ Competition
Nikolova, Valya, Kircheva, Nikoleta, Dobrev, Stefan, Angelova, Silvia, Dudev, Todor
Published in International journal of molecular sciences (27.03.2023)
Published in International journal of molecular sciences (27.03.2023)
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A DFT/PCM Study on the Affinity of Salinomycin to Bind Monovalent Metal Cations
Dudev, Todor, Cheshmedzhieva, Diana, Dorkov, Peter, Pantcheva, Ivayla
Published in Molecules (Basel, Switzerland) (14.01.2022)
Published in Molecules (Basel, Switzerland) (14.01.2022)
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Metal-Assisted Complexation of Fluorogenic Dyes by Cucurbit[7]uril and Cucurbit[8]uril: A DFT Evaluation of the Key Factors Governing the Host-Guest Recognition
Kircheva, Nikoleta, Dobrev, Stefan, Dasheva, Lyubima, Nikolova, Valya, Angelova, Silvia, Dudev, Todor
Published in Molecules (Basel, Switzerland) (05.02.2023)
Published in Molecules (Basel, Switzerland) (05.02.2023)
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N -Methyl- and N -Phenylpiperazine Functionalized Styryl Dyes Inside Cucurbiturils: Theoretical Assessment of the Factors Governing the Host-Guest Recognition
Kircheva, Nikoleta, Petkova, Vladislava, Dobrev, Stefan, Nikolova, Valya, Angelova, Silvia, Dudev, Todor
Published in Molecules (Basel, Switzerland) (16.12.2023)
Published in Molecules (Basel, Switzerland) (16.12.2023)
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Complexation of trivalent metal cations (Al, Ga, In, La, Lu) to cucurbiturils: a DFT/SMD evaluation of the key factors governing the host-guest recognition
Koleva, Iskra Z, Dobrev, Stefan, Kircheva, Nikoleta, Dasheva, Lyubima, Nikolova, Valya, Angelova, Silvia, Dudev, Todor
Published in Physical chemistry chemical physics : PCCP (09.03.2022)
Published in Physical chemistry chemical physics : PCCP (09.03.2022)
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Naphthalimide-Based Amphiphiles: Synthesis and DFT Studies of the Aggregation and Interaction of a Simplified Model System with Water Molecules
Petkova, Vladislava, Anastasova, Denitsa, Dobrev, Stefan, Mutovska, Monika, Kircheva, Nikoleta, Nikolova, Valya, Kolev, Spas D, Stoyanov, Stanimir, Zagranyarski, Yulian, Dudev, Todor, Angelova, Silvia
Published in Molecules (Basel, Switzerland) (04.09.2024)
Published in Molecules (Basel, Switzerland) (04.09.2024)
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