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Scientific topics: Computational chemistry
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and Keywords: data-management
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Scientific topic
- Computational chemistry
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- GTN1
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Keyword
- data-management
- Computational chemistry8
- computational-chemistry2
- Alphafoldology1
- Autodock Vina1
- Chemical biology1
- Cheminformatics1
- De novo modeling1
- Drug design1
- Drug-like molecules1
- FAIR Data, Workflows, and Research1
- Molecular docking1
- PDBe1
- PDBe-KB1
- Pharmacophores1
- QSAR1
- chemography1
- covid191
- drug discovery1
- fair1
- in silico drug design1
- 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
- medicinal-chemistry1
- molecular modelling1
- one-health1
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Competency level
- Beginner1
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- Students1
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Contributor
- Helena Rasche1
- Khaled Jum'ah1
- Simon Bray1
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- e-learning1
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- Associated Workflows1
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