Fast and Reliable NMR-Based Fragment Scoring for Drug Discovery [Dataset]
Nonspecific binding effects, KD values for HSA and fascin complexes, ML models data, NMR spectra, Bruker pulse programs and processing script
| Autores: | , , , , |
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| Tipo de documento: | conjunto de datos |
| Data de publicação: | 2025 |
| País: | España |
| Recursos: | Consejo Superior de Investigaciones Científicas (CSIC) |
| Repositório: | DIGITAL.CSIC. Repositorio Institucional del CSIC |
| OAI Identifier: | oai:digital.csic.es:10261/416916 |
| Acesso em linha: | http://hdl.handle.net/10261/416916 |
| Access Level: | Acceso aberto |
| Palavra-chave: | Machine learning model Ligand titration curves Based drug discovery Biophysics Biochemistry |
| Resumo: | Nonspecific binding effects, KD values for HSA and fascin complexes, ML models data, NMR spectra, Bruker pulse programs and processing script |
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