Search results
- 1.0507836 - ÚMCH 2020 RIV US eng J - Journal Article
Hušák, M. - Jegorov, A. - Czernek, Jiří - Rohlíček, J. - Žižková, S. - Vraspír, P. - Kolesa, P. - Fitch, A. - Brus, Jiří
Successful strategy for high degree of freedom crystal structure determination from powder X-ray diffraction data: a case study for selexipag form I with 38 DOF.
Crystal Growth & Design. Roč. 19, č. 8 (2019), s. 4625-4631. ISSN 1528-7483. E-ISSN 1528-7505
R&D Projects: GA MŠMT(CZ) LTAUSA18011
Institutional support: RVO:61389013
Keywords : powder X-ray diffraction * DFT methods
OECD category: Physical chemistry
Impact factor: 4.089, year: 2019
Method of publishing: Limited access
https://pubs.acs.org/doi/10.1021/acs.cgd.9b00517
Permanent Link: http://hdl.handle.net/11104/0298863 - 2.0499623 - FZÚ 2019 RIV US eng J - Journal Article
Hušák, M. - Jegorov, A. - Rohlíček, Jan - Fitch, A. - Czernek, Jiří - Kobera, Libor - Brus, Jiří
Determining the crystal structures of peptide analogs of boronic acid in the absence of single crystals: intricate motifs of ixazomib citrate revealed by XRPD guided by ss-NMR.
Crystal Growth & Design. Roč. 18, č. 6 (2018), s. 3616-3625. ISSN 1528-7483. E-ISSN 1528-7505
R&D Projects: GA ČR GA16-10035S; GA ČR(CZ) GA16-04109S; GA MŠMT(CZ) LO1507
Institutional support: RVO:68378271 ; RVO:61389013
Keywords : crystal structure * powder diffraction * NMR
OECD category: Condensed matter physics (including formerly solid state physics, supercond.); Polymer science (UMCH-V)
Impact factor: 4.153, year: 2018
Permanent Link: http://hdl.handle.net/11104/0291857 - 3.0484877 - ÚFE 2018 RIV GB eng J - Journal Article
Cajzl, Jakub - Nekvindová, P. - Macková, Anna - Malinský, Petr - Sedmidubský, D. - Hušák, M. - Remeš, Zdeněk - Varga, Marián - Kromka, Alexander - Bottger, R. - Oswald, Jiří … Total 12 authors
Erbium ion implantation into diamond-measurement and modelling of the crystal structure.
Physical Chemistry Chemical Physics. Roč. 19, č. 8 (2017), s. 6233-6245. ISSN 1463-9076. E-ISSN 1463-9084
R&D Projects: GA MŠMT(CZ) LD15003; GA ČR(CZ) GA14-05053S; GA MŠMT LM2015056
Institutional support: RVO:67985882 ; RVO:68378271 ; RVO:61389005
Keywords : nanodiamond * films * silicon
OECD category: Condensed matter physics (including formerly solid state physics, supercond.); Condensed matter physics (including formerly solid state physics, supercond.) (FZU-D); Condensed matter physics (including formerly solid state physics, supercond.) (UJF-V)
Impact factor: 3.906, year: 2017
Permanent Link: http://hdl.handle.net/11104/0280005File Download Size Commentary Version Access UFE 0484877.pdf 5 4.2 MB Other require - 4.0482888 - FZÚ 2018 RIV CH eng J - Journal Article
Černý, R. - Favre-Nicolin, V. - Rohlíček, Jan - Hušák, M.
FOX, current state and possibilities.
Crystals. Roč. 7, č. 10 (2017), s. 1-9, č. článku 322. ISSN 2073-4352. E-ISSN 2073-4352
Institutional support: RVO:68378271
Keywords : powder diffraction * crystal structure solution * global optimization * reversed Monte Carlo * simulated annealing
OECD category: Computer hardware and architecture
Impact factor: 2.144, year: 2017
Permanent Link: http://hdl.handle.net/11104/0278275 - 5.0480929 - ÚOCHB 2018 RIV US eng J - Journal Article
Skořepová, E. - Bím, Daniel - Hušák, M. - Klimeš, J. - Chatziadi, A. - Ridvan, L. - Boleslavská, T. - Beránek, J. - Šebek, P. - Rulíšek, Lubomír
Increase in Solubility of Poorly-Ionizable Pharmaceuticals by Salt Formation: A Case of Agomelatine Sulfonates.
Crystal Growth & Design. Roč. 17, č. 10 (2017), s. 5283-5294. ISSN 1528-7483. E-ISSN 1528-7505
Institutional support: RVO:61388963
Keywords : density functional theory * crystal structures * trospium chloride
OECD category: Physical chemistry
Impact factor: 3.972, year: 2017
Permanent Link: http://hdl.handle.net/11104/0276581 - 6.0465888 - FZÚ 2017 RIV GB eng J - Journal Article
Skořepová, E. - Hušák, M. - Ridvan, L. - Tkadlecová, M. - Havlíček, J. - Dušek, Michal
Iodine salts of the pharmaceutical compound agomelatine: the effect of the symmetric H-bond on amide protonation.
CrystEngComm. Roč. 18, č. 24 (2016), s. 4518-4529. ISSN 1466-8033
R&D Projects: GA ČR GA15-12653S; GA MŠMT LO1603
EU Projects: European Commission(XE) CZ.2.16/3.1.00/24510
Institutional support: RVO:68378271
Keywords : agomelatine * crystal structure * API * iodides * symmetric hydrogen bond
Subject RIV: BM - Solid Matter Physics ; Magnetism
Impact factor: 3.474, year: 2016
Permanent Link: http://hdl.handle.net/11104/0265113 - 7.0425014 - FZÚ 2014 RIV US eng J - Journal Article
Skořepová, E. - Čejka, J. - Hušák, M. - Eigner, Václav - Rohlíček, Jan - Šturc, A. - Kratochvíl, B.
Trospium chloride: Unusual example of polymorphism based on structure disorder.
Crystal Growth & Design. Roč. 13, č. 12 (2013), s. 5193-5203. ISSN 1528-7483. E-ISSN 1528-7505
Grant - others:AV ČR(CZ) AP0701
Program: Akademická prémie - Praemium Academiae
Institutional support: RVO:68378271
Keywords : disorder * X-ray study * API
Subject RIV: CC - Organic Chemistry
Impact factor: 4.558, year: 2013
Permanent Link: http://hdl.handle.net/11104/0230971 - 8.0343202 - ÚMCH 2011 RIV US eng J - Journal Article
Hušák, M. - Kratochvíl, B. - Jegorov, A. - Brus, Jiří - Maixner, J. - Rohlíček, J.
Simvastatin: structure solution of two new low-temperature phases from synchrotron powder diffraction and ss-NMR.
Structural Chemistry. Roč. 21, č. 3 (2010), s. 511-518. ISSN 1040-0400. E-ISSN 1572-9001
R&D Projects: GA AV ČR IAA400500602; GA MŠMT 2B08021
Institutional research plan: CEZ:AV0Z40500505
Keywords : crystal structure * simvastatin * powder diffraction
Subject RIV: CD - Macromolecular Chemistry
Impact factor: 1.727, year: 2010
Permanent Link: http://hdl.handle.net/11104/0005900 - 9.0340757 - MBÚ 2010 RIV DE eng J - Journal Article
Jegorov, A. - Havlíček, Vladimír - Hušák, M. - Kratochvíl, B. - Císařová, I. - Satke, J. - Žabka, M.
Crystal structure of cyclo(2-hydroxy-i-valeryl-isoleucyl-2-hydroxy-i-valeryl-alanyl-threonyl) dihydrate, C23H39N3O8 center dot 2H(2)O.
Zeitschrift fur Kristallographie-New Crystal Structures. Roč. 220, č. 1 (2005), s. 113-115. ISSN 1433-7266. E-ISSN 2197-4578
R&D Projects: GA ČR GA203/02/1417
Institutional research plan: CEZ:AV0Z50200510
Keywords : crystal structure * trichothecium roseum * dihydrate
Subject RIV: CC - Organic Chemistry
Impact factor: 0.312, year: 2005
Permanent Link: http://hdl.handle.net/11104/0183936 - 10.0321880 - ÚMG 2009 RIV CZ eng J - Journal Article
Kratochvíl, B. - Hušák, M. - Brynda, Jiří - Sedláček, Juraj
What is proposed by current X-ray structural analysis?
[Co nabízí současná RTG analýza?]
Chemické listy. Roč. 102, - (2008), s. 889-901. ISSN 0009-2770. E-ISSN 1213-7103
Institutional research plan: CEZ:AV0Z50520514
Keywords : powder diffraction data * protein crystallography * molecular replacement * crystal - structures * HIV-1 protease
Subject RIV: EB - Genetics ; Molecular Biology
Impact factor: 0.593, year: 2008
Permanent Link: http://hdl.handle.net/11104/0170292