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Published in 2018 at "Small"
DOI: 10.1002/smll.201801989
Abstract: • A submitted manuscript is the version of the article upon submission and before peer-review. There can be important differences between the submitted version and the official published version of record. People interested in the…
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Keywords:
desired properties;
version;
microstructure fabrication;
properties suitable ... See more keywords
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Published in 2023 at "Briefings in bioinformatics"
DOI: 10.1093/bib/bbad185
Abstract: The rational design of chemical entities with desired properties for a specific target is a long-standing challenge in drug design. Generative neural networks have emerged as a powerful approach to sample novel molecules with specific…
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Keywords:
desired properties;
molecular generation;
design;
generation net ... See more keywords