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zadetkov: 65
1.
  • A road map for prioritizing... A road map for prioritizing warheads for cysteine targeting covalent inhibitors
    Ábrányi-Balogh, Péter; Petri, László; Imre, Tímea ... European journal of medicinal chemistry, 12/2018, Letnik: 160
    Journal Article
    Recenzirano

    Targeted covalent inhibitors have become an integral part of a number of therapeutic protocols and are the subject of intense research. The mechanism of action of these compounds involves the ...
Celotno besedilo
2.
  • Covalent Docking in Drug Discovery: Scope and Limitations
    Scarpino, Andrea; Ferenczy, György G; Keserű, György M Current pharmaceutical design, 01/2020, Letnik: 26, Številka: 44
    Journal Article
    Recenzirano

    Drug discovery efforts for new covalent inhibitors have drastically increased in the last few years. The binding mechanism of covalent compounds entails the formation of a chemical bond between their ...
Preverite dostopnost
3.
  • Undocumented Undocumented
    Scarpino, Andrea; Riekki, Ronald 03/2019
    eBook

    Focusing on contemporary issues, this text showcases a large collection of regional poets laureate writing on subjects critical to understanding social justice as it relates to the Great Lakes ...
Celotno besedilo
4.
  • Discovery of Immunoproteaso... Discovery of Immunoproteasome Inhibitors Using Large-Scale Covalent Virtual Screening
    Scarpino, Andrea; Bajusz, Dávid; Proj, Matic ... Molecules (Basel, Switzerland), 07/2019, Letnik: 24, Številka: 14
    Journal Article
    Recenzirano
    Odprti dostop

    Large-scale virtual screening of boronic acid derivatives was performed to identify nonpeptidic covalent inhibitors of the β5i subunit of the immunoproteasome. A hierarchical virtual screening ...
Celotno besedilo

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5.
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6.
  • Comparative Evaluation of C... Comparative Evaluation of Covalent Docking Tools
    Scarpino, Andrea; Ferenczy, György G; Keserű, György M Journal of chemical information and modeling, 07/2018, Letnik: 58, Številka: 7
    Journal Article
    Recenzirano

    Increased interest in covalent drug discovery led to the development of computer programs predicting binding mode and affinity of covalent inhibitors. Here we compare the performance of six covalent ...
Celotno besedilo
7.
  • Design and Evaluation of Co... Design and Evaluation of Covalent Docking Protocols for Drug Discovery
    Scarpino, Andrea 01/2020
    Dissertation

    Through the last decades, drug discovery has benefited from breakthrough innovations made in all of the branches of this interdisciplinary field. A deeper understanding of pathophysiological ...
Celotno besedilo
8.
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9.
  • Binding Mode Prediction and Virtual Screening Applications by Covalent Docking
    Scarpino, Andrea; Ferenczy, György G; Keserű, György M Methods in molecular biology (Clifton, N.J.), 2021, Letnik: 2266
    Journal Article

    The mechanism of action of covalent drugs involves the formation of a bond between their electrophilic warhead group and a nucleophilic residue of the protein target. The recent advances in covalent ...
Preverite dostopnost
10.
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zadetkov: 65

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