Zobrazeno 1 - 5
of 5
pro vyhledávání: '"Patrycja Spychalska"'
Autor:
Agata Raczyńska, Patryk Kapica, Katarzyna Papaj, Agnieszka Stańczak, Divine Shyntum, Patrycja Spychalska, Anna Byczek-Wyrostek, Artur Góra
Publikováno v:
PLoS ONE, Vol 18, Iss 2, p e0280776 (2023)
The haloalkane dehalogenase LinB is a well-known enzyme that contains buried active site and is used for many modelling studies. Using classical molecular dynamics simulations of enzymes and substrates, we searched for transient binding sites on the
Externí odkaz:
https://doaj.org/article/8d0b66bfe41d451d85873b96028d725e
Autor:
Katarzyna Papaj, Patrycja Spychalska, Patryk Kapica, André Fischer, Jakub Nowak, Maria Bzówka, Manuel Sellner, Markus A. Lill, Martin Smieško, Artur Góra
Publikováno v:
PLoS ONE, Vol 17, Iss 1 (2022)
Based on previous large-scale in silico screening several factor Xa inhibitors were proposed to potentially inhibit SARS-CoV-2 Mpro. In addition to their known anticoagulants activity this potential inhibition could have an additional therapeutic eff
Externí odkaz:
https://doaj.org/article/a5bf9b16c24c4d5a81c32141595dbc98
Autor:
Katarzyna Papaj, Patrycja Spychalska, Katarzyna Hopko, Patryk Kapica, Andre Fisher, Markus A. Lill, Weronika Bagrowska, Jakub Nowak, Katarzyna Szleper, Martin Smieško, Anna Kasprzycka, Artur Góra
Publikováno v:
Pharmaceuticals, Vol 14, Iss 11, p 1153 (2021)
In the present study we tested, using the microscale thermophoresis technique, a small library of thionocarbamates, thiolocarbamates, sulfide and disulfide as potential lead compounds for SARS-CoV-2 Mpro drug design. The successfully identified binde
Externí odkaz:
https://doaj.org/article/cfc8ba5fbeaa4b28b89a3a1f556103ea
Autor:
Patryk Kapica, Patrycja Spychalska, Artur Góra, Markus A. Lill, Katarzyna Papaj, Katarzyna Szleper, Anna Kasprzycka, Weronika Bagrowska, Jakub Nowak, Katarzyna Hopko, Martin Smieško, Andre Fisher
Publikováno v:
Pharmaceuticals
Pharmaceuticals, Vol 14, Iss 1153, p 1153 (2021)
Pharmaceuticals, Vol 14, Iss 1153, p 1153 (2021)
In the present study we tested, using the microscale thermophoresis technique, a small library of thionocarbamates, thiolocarbamates, sulfide and disulfide as potential lead compounds for SARS-CoV-2 Mpro drug design. The successfully identified binde
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::4985594bf4c3b7b8d3312a964935d1dc
https://pubmed.ncbi.nlm.nih.gov/34832935
https://pubmed.ncbi.nlm.nih.gov/34832935
Autor:
Kamil Kaminski, Dawid Heczko, Anna Kasprzycka, Karolina Jurkiewicz, Marian Paluch, Patrycja Spychalska, Joanna Grelska, Ewa Kamińska
Publikováno v:
Journal of Molecular Liquids. 336:116321
In this paper, broadband dielectric spectroscopy (BDS) was applied to study the molecular dynamics of the methyl, acetyl, and silyl derivatives of trehalose, TRE (metTRE, acTRE, and silTRE, respectively) at high pressure (p). Unexpectedly, our invest
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::24ea2c8cf5a96a36de07c63b3bf917ed
https://doi.org/10.1016/j.molliq.2021.116321
https://doi.org/10.1016/j.molliq.2021.116321