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Towards systematic exploration of chemical space: building the fragment library module in molecular property diagnostic suite

A fragment-based drug discovery (FBDD) approach has traditionally been of utmost significance in drug design studies. It allows the exploration of large chemical space to find novel scaffolds and chemotypes which can be improved into selective inhibitors with good affinity. In the current work, seve...

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Detalles Bibliográficos
Autores principales: Gaur, Anamika Singh, John, Lijo, Kumar, Nandan, Vivek, M. Ram, Nagamani, Selvaraman, Mahanta, Hridoy Jyoti, Sastry, G. Narahari
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Springer International Publishing 2022
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9362107/
https://www.ncbi.nlm.nih.gov/pubmed/35925528
http://dx.doi.org/10.1007/s11030-022-10506-5