Contact
Email: | , |
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Phone: | +420 54949 5459 |
Research group: | Computational Chemistry - Jaroslav Koča |
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Publications that are part of the Web of Science database, possibly also other publications chosen by authors.
2020
- Bouchal, T; Durník, I; Illík, V; Réblová, K; Kulhánek, P, 2020: Importance of base-pair opening for mismatch recognition. NUCLEIC ACIDS RESEARCH , doi: 10.1093/nar/gkaa896
- Kulkarni, SG; Jelinkova, K; Necas, M; Pruckova, Z; Rouchal, M; Dastychova, L; Kulhanek, P; Vicha, R, 2020: A Photochemical/Thermal Switch Based on 4,4 ´-Bis(benzimidazolio)stilbene: Synthesis and Supramolecular Properties.. CHEMPHYSCHEM 21(18), p. 2084 - 2095, doi: 10.1002/cphc.202000472
2019
- Ruzicka, M; Soucek, R; Kulhanek, P; Radova, L; Fajkusova, L; Reblova, K, 2019: Bending of DNA duplexes with mutation motifs. DNA RESEARCH 26(4), p. 341 - 352, doi: 10.1093/dnares/dsz013
2018
- Stepan, J; Kabelka, I; Koca, J; Kulhanek, P, 2018: Behavior of BsoBI endonuclease in the presence and absence of DNA. JOURNAL OF MOLECULAR MODELING 24(1), doi: 10.1007/s00894-017-3557-8
2017
- Ruzicka, M; Kulhanek, P; Radova, L; Cechova, A; Spackova, N; Fajkusova, L; Reblova, K, 2017: DNA mutation motifs in the genes associated with inherited diseases. PLOS ONE 12(8), doi: 10.1371/journal.pone.0182377
- Fiala, T; Ludvikova, L; Heger, D; Svec, J; Slanina, T; Vetrakova, L; Babiak, M; Necas, M; Kulhanek, P; Klan, P; Sindelar, V, 2017: Bambusuril as a One-Electron Donor for Photoinduced Electron Transfer to Methyl Viologen in Mixed Crystals. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY 139(7), p. 2597 - 2603, doi: 10.1021/jacs.6b08589
2016
- Ustrnul, L; Babiak, M; Kulhanek, P; Sindelar, V, 2016: A Cucurbituril Derivative That Exhibits Cation-Modulated Self Assembly. JOURNAL OF ORGANIC CHEMISTRY 81(14), p. 6075 - 6080, doi: 10.1021/acs.joc.6b01288
- Strelcova, Z; Kulhanek, P; Friak, M; Fabritius, HO; Petrov, M; Neugebauer, J; Koca, J, 2016: The structure and dynamics of chitin nanofibrils in an aqueous environment revealed by molecular dynamics simulations. RSC ADVANCES 6(36), p. 30710 - 30721, doi: 10.1039/c6ra00107f
- Mikulasek, K; Jaron, KS; Kulhanek, P; Bittova, M; Havlis, J, 2016: Sequence-dependent separation of trinucleotides by ion-interaction reversed-phase liquid chromatography A structure-retention study assisted by soft-modelling and molecular dynamics. JOURNAL OF CHROMATOGRAPHY A 1469, p. 88 - 95, doi: 10.1016/j.chroma.2016.09.060
- Branna, P; Cernochova, J; Rouchal, M; Kulhanek, P; Babinsky, M; Marek, R; Necas, M; Kuritka, I; Vicha, R, 2016: Cooperative Binding of Cucurbit[n]urils and beta-Cyclodextrin to Heteroditopic Imidazolium-Based Guests. JOURNAL OF ORGANIC CHEMISTRY 81(20), p. 9595 - 9604, doi: 10.1021/acs.joc.6b01564
2015
- Reblova, K; Kulhanek, P; Fajkusova, L, 2015: Computational study of missense mutations in phenylalanine hydroxylase. JOURNAL OF MOLECULAR MODELING 21(4), doi: 10.1007/s00894-015-2620-6
2014
- Novotny, J; Yurenko, YP; Kulhanek, P; Marek, R, 2014: Tailoring the properties of quadruplex nucleobases for biological and nanomaterial applications. PHYSICAL CHEMISTRY CHEMICAL PHYSICS 16(29), p. 15241 - 15248, doi: 10.1039/c4cp00541d
2013
- Standara, S; Kulhanek, P; Marek, R; Straka, M, 2013: Xe-129 NMR chemical shift in Xe@C-60 calculated at experimental conditions: Essential role of the relativity, dynamics, and explicit solvent. JOURNAL OF COMPUTATIONAL CHEMISTRY 34(22), p. 1890 - 1898, doi: 10.1002/jcc.23334
2012
- Cernochova, J; Branna, P; Rouchal, M; Kulhanek, P; Kuritka, I; Vicha, R, 2012: Determination of Intrinsic Binding Modes by Mass Spectrometry: Gas-Phase Behavior of Adamantylated Bisimidazolium Guests Complexed to Cucurbiturils. CHEMISTRY-A EUROPEAN JOURNAL 18(43), p. 13633 - 13637, doi: 10.1002/chem.201201444
- Novotny, J; Kulhanek, P; Marek, R, 2012: Biocompatible Xanthine-Quadruplex Scaffold for Ion-Transporting DNA Channels. JOURNAL OF PHYSICAL CHEMISTRY LETTERS 3(13), p. 1788 - 1792, doi: 10.1021/jz300559w
2010
- Kolman, V; Kulhanek, P; Sindelar, V, 2010: Inclusion of Carboxyl Function Inside of Cucurbiturils and its Use in Molecular Switches. CHEMISTRY-AN ASIAN JOURNAL 5(11), p. 2386 - 2392, doi: 10.1002/asia.201000388
- Advanced carbon@MOF composites for gas storage and separation (5SA15060), Jihomoravský kraj, 2017 - 2020
- Czech National Infrastructure for Biological Data (LM2015047), Ministerstvo školství, mládeže a tělovýchovy ČR, 2016 - 2019
- Struktura a vlastnosti paramagnetických komplexů ruthenia pro návrh nových protirakovinných léčiv (GA15-09381S), Grantová agentura ČR, 2015 - 2017