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Interplay of halogen bonding and solvation in protein-ligand binding.
iScience. 2024 Mar 29;27(4):109636. doi: 10.1016/j.isci.2024.109636. eCollection 2024 Apr 19.
iScience. 2024.
PMID: 38633000
Free PMC article.
Interrogation of an Enzyme Library Reveals the Catalytic Plasticity of Naturally Evolved [4+2] Cyclases.
Zorn K, Back CR, Barringer R, Chadimová V, Manzo-Ruiz M, Mbatha SZ, Mobarec JC, Williams SE, van der Kamp MW, Race PR, Willis CL, Hayes MA.
Zorn K, et al. Among authors: chadimova v.
Chembiochem. 2023 Jul 17;24(14):e202300382. doi: 10.1002/cbic.202300382. Epub 2023 Jun 18.
Chembiochem. 2023.
PMID: 37305956
Free PMC article.
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Retrosynthetic accessibility score (RAscore) - rapid machine learned synthesizability classification from AI driven retrosynthetic planning.
Thakkar A, Chadimová V, Bjerrum EJ, Engkvist O, Reymond JL.
Thakkar A, et al. Among authors: chadimova v.
Chem Sci. 2021 Jan 22;12(9):3339-3349. doi: 10.1039/d0sc05401a.
Chem Sci. 2021.
PMID: 34164104
Free PMC article.
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AiZynthFinder: a fast, robust and flexible open-source software for retrosynthetic planning.
Genheden S, Thakkar A, Chadimová V, Reymond JL, Engkvist O, Bjerrum E.
Genheden S, et al. Among authors: chadimova v.
J Cheminform. 2020 Nov 17;12(1):70. doi: 10.1186/s13321-020-00472-1.
J Cheminform. 2020.
PMID: 33292482
Free PMC article.
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Solid-state photocrosslinking of hyaluronan microfibres.
Bobula T, Běťák J, Buffa R, Moravcová M, Klein P, Židek O, Chadimová V, Pospíšil R, Velebný V.
Bobula T, et al. Among authors: chadimova v.
Carbohydr Polym. 2015 Jul 10;125:153-60. doi: 10.1016/j.carbpol.2015.02.027. Epub 2015 Feb 23.
Carbohydr Polym. 2015.
PMID: 25857970
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