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Retrosynthetic accessibility score (RAscore) - rapid machine learned synthesizability classification from AI driven retrosynthetic planning.
Chem Sci. 2021 Jan 22;12(9):3339-3349. doi: 10.1039/d0sc05401a.
Chem Sci. 2021.
PMID: 34164104
Free PMC article.
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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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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Interplay of halogen bonding and solvation in protein-ligand binding.
Verteramo ML, Ignjatović MM, Kumar R, Wernersson S, Ekberg V, Wallerstein J, Carlström G, Chadimová V, Leffler H, Zetterberg F, Logan DT, Ryde U, Akke M, Nilsson UJ.
Verteramo ML, et al. Among authors: chadimova v.
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.
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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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