Learning on topological surface and geometric structure for 3D molecular generation
Author:
Publisher
Springer Science and Business Media LLC
Subject
Computer Networks and Communications,Computer Science Applications,Computer Science (miscellaneous)
Link
https://www.nature.com/articles/s43588-023-00530-2.pdf
Reference49 articles.
1. Ferreira, L. G., Dos Santos, R. N., Oliva, G. & Andricopulo, A. D. Molecular docking and structure-based drug design strategies. Molecules 20, 13384–13421 (2015).
2. Anderson, A. C. The process of structure-based drug design. Chem. Biol. 10, 787–797 (2003).
3. Shoichet, B. K. Virtual screening of chemical libraries. Nature 432, 862–865 (2004).
4. Böhm, H.-J. The computer program LUDI: a new method for the de novo design of enzyme inhibitors. J. Comput. Aided Mol. Des. 6, 61–78 (1992).
5. Wang, R., Gao, Y. & Lai, L. LigBuilder: a multi-purpose program for structure-based drug design. Mol. Model. Annu. 6, 498–516 (2000).
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