Items where Author is "Karabencheva-Christova, Tatyana"

Chaturvedi, Shobhit, Ramanan, Rajeev, Waheed, Sodiq, Ainsley, Jon, Evison, Martin, Ames, Jenny, Schofield, Christopher, Karabencheva-Christova, Tatyana and Christov, Christo (2019) Conformational Dynamics Underlies Different Functions of Human KDM7 Histone Demethylases. Chemistry - A European Journal, 25 (21). pp. 5422-5426. ISSN 0947-6539

Karabencheva-Christova, Tatyana, Christov, Christo and Fields, Gregg (2017) Collagenolytic Matrix Metalloproteinase Structure–Function Relationships: Insights From Molecular Dynamics Studies. In: Advances in Protein Chemistry and Structural Biology. Elsevier, pp. 1-24. ISBN 978-0-12-811876-4

Singh, Warispreet, Fields, Gregg, Christov, Christo and Karabencheva-Christova, Tatyana (2016) Effects of Mutations on Structure–Function Relationships of Matrix Metalloproteinase-1. International Journal of Molecular Sciences, 17 (10). p. 1727. ISSN 1422-0067

Singh, Warispreet, Karabencheva-Christova, Tatyana, Black, Gary, Ainsley, Jon, Dover, Lynn and Christov, Christo (2016) Conformational dynamics, ligand binding and effects of mutations in NirE an S-adenosyl-L-methionine dependent Methyltransferase. Scientific Reports, 6. p. 20107. ISSN 2045-2322

Singh, Warispreet, Karabencheva-Christova, Tatyana, Black, Gary, Sparagano, Olivier and Christov, Christo (2016) Conformational flexibility influences structure–function relationships in tyrosyl protein sulfotransferase-2. RSC Advances, 6 (14). pp. 11344-11352. ISSN 2046-2069

Singh, Warispreet, Karabencheva-Christova, Tatyana, Sparagano, Olivier, Black, Gary, Petrov, Petar and Christov, Christo (2016) Dimerization and ligand binding in tyrosylprotein sulfotransferase-2 are influenced by molecular motions. RSC Advances, 6 (22). pp. 18542-18548. ISSN 2046-2069

Singh, Warispreet, Fields, Gregg, Christov, Christo and Karabencheva-Christova, Tatyana (2016) Importance of the linker region in matrix metalloproteinase-1 domain interactions. RSC Advances, 6 (28). pp. 23223-23232. ISSN 2046-2069

Karabencheva-Christova, Tatyana (2015) Combined Quantum Mechanical and Molecular Mechanical Modelling of Biomolecular Interactions. Advances in Protein Chemistry and Structural Biology . Elsevier, London. ISBN 9780128020036

Karabencheva-Christova, Tatyana, Singh, Warispreet and Christov, Christo (2014) Computational Study of the Structure, the Flexibility, and the Electronic Circular Dichroism of Staurosporine – a Powerful Protein Kinase Inhibitor. Zeitschrift fur Naturforschung A (Journal of Physical Sciences), 69 (7). pp. 331-338. ISSN 0932-0784

Karabencheva-Christova, Tatyana, Lee, Christian, Black, Gary, Donev, Rossen and Christov, Christo (2014) How does conformational flexibility influence key structural features involved in activation of anaplastic lymphoma kinase? Molecular BioSystems, 10. pp. 1490-1495. ISSN 1742-206X

Karabencheva-Christova, Tatyana (2014) Preface. In: Biomolecular Modelling and Simulations. Advances in Protein Chemistry and Structural Biology, 96 . Elsevier, London, XIII-XIV. ISBN 978-0-12-800013-7

Karabencheva-Christova, Tatyana (2013) Dynamics of proteins and nucleic acids. Advances in Protein Chemistry and Structural Biology, 92 . Academic Press, Amsterdam, ix-x. ISBN 978-0124116276

Christov, Christo, Lodola, Alessio, Karabencheva-Christova, Tatyana, Wan, Shunzhou, Coveney, Peter and Mulholland, Adrian (2013) Conformational effects on the pro-S hydrogen abstraction reaction in cyclooxygenase-1: an integrated QM/MM and MD study. Biophysical Journal, 104 (5). L5-L7. ISSN 0006-3495

Karabencheva-Christova, Tatyana, Carlsson, Uno, Balali-Mood, Kia, Black, Gary and Christov, Christo (2013) Conformational effects on the Circular Dichroism of Human Carbonic Anhydrase II: a multilevel computational study. PLoS ONE, 8 (2). e56874. ISSN 1932-6203

Karabencheva-Christova, Tatyana (2013) Introduction to dynamics of proteins and nucleic acids. Advances in Protein Chemistry and Structural Biology, 92. ix-x. ISSN 1876-1631

Karabencheva-Christova, Tatyana and Christov, Christo (2012) Structural and computational enzymology: bringing experiments and computations together. Advances in Protein Chemistry and Structural Biology, 87. pp. 1-4. ISSN 1876-1623

Christov, Christo, González-Bulnes, Patricia, Malhaire, Fanny, Karabencheva-Christova, Tatyana, Goudet, Cyril, Pin, Jean-Philippe, Llebaria, Amadeu and Giraldo, Jesús (2011) Integrated Synthetic, Pharmacological, and Computational Investigation of cis-2-(3,5-Dichlorophenylcarbamoyl) cyclohexanecarboxylic Acid Enantiomers As Positive Allosteric Modulators of Metabotropic Glutamate Receptor Subtype 4. ChemMedChem, 6 (1). pp. 131-140. ISSN 1860-7179

Christov, Christo and Karabencheva-Christova, Tatyana (2011) Computational insight into protein circular dichroism: detailed analysis of contributions of individual chromophores in TEM-1 β-lactamase. Theoretical Chemistry Accounts: Theory, Computation and Modelling., 28 (1). pp. 25-37. ISSN 1432-881X

Karabencheva-Christova, Tatyana, Donev, Rossen, Balali-Mood, Kia and Christov, Christo (2010) Individual contributions of the aromatic chromophores to the near-UV Circular Dichroism in class A β-lactamases: A comparative computational analysis. Biophysical Chemistry, 151 (1-2). pp. 39-45. ISSN 0301-4622

Karabencheva-Christova, Tatyana and Christov, Christo (2010) Mechanisms of protein circular dichroism: insights from computational modeling. Advances in Protein Chemistry and Structural Biology, 80. pp. 85-115. ISSN 1876-1623

Christov, Christo, Karabencheva-Christova, Tatyana and Lodola, Alessio (2008) Relationship between chiroptical properties, structural changes and interactions in enzymes: A computational study on β-lactamases from class A. Computational Biology and Chemistry, 32 (3). pp. 167-175. ISSN 1476-9271

Christov, Christo, Karabencheva-Christova, Tatyana and Lodola, Alessio (2008) Aromatic interactions and rotational strengths within protein environment: An electronic structural study on β-lactamases from class A. Chemical Physics Letters, 456 (1-3). pp. 89-95. ISSN 0009-2614