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Scientific topic
- Molecular docking
- Biomathematics1
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- ELIXIR: The Czech Republic Node1
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Keyword
- in silico drug design, Drug design, Drug discovery, Drug screening, pharmacophore, chemical biology, QSAR, Molecular docking, molecular modelling, PDBe, PDBe-KB, ChEMBL, De novo, deep learning, cheminformatics, AlphaFold, Quantum mechanics/molecular mechanics1
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Author
- Genevieve Evans
- Aleksandra Ivanova2
- Federica Moraca2
- Guzel Minibaeva2
- Johannes Kirchmair2
- Karel Berka2
- Martin Lepšík2
- Pavel Polishchuk2
- Semen Yesylevskyy2
- Thierry Langer2
- Wim Dehaen2
- Alexander Domling1
- Alexandre Varnek1
- Alžběta Tuerková1
- Anna Špačková1
- Dominik Martinat1
- Hanoch Senderowicz1
- Kateřina Storchmannová1
- Marian Hajduch1
- Marian Novotny1
- Martin Šícho1
- Miroslav Lžičař1
- Paulyna Magana1
- Thomas Evangelidis1
- Vaclav Bazgier1
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Contributor
- Anna Špačková1
- Dominik Martinat1
- Kateřina Storchmannová1
- Nina Kadášová1
- Vaclav Bazgier1
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