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LigMerge: A Fast Algorithm to Generate Models of Novel Potential Ligands from Sets of Known Binders
One common practice in drug discovery is to optimize known or suspected ligands in order to improve binding affinity. In performing these optimizations, it is useful to look at as many known inhibitors as possible for guidance. Medicinal chemists often seek to improve potency by altering certain che...
| Autores principales: | , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
Blackwell Publishing Ltd
2012
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| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3462068/ https://www.ncbi.nlm.nih.gov/pubmed/22594624 http://dx.doi.org/10.1111/j.1747-0285.2012.01414.x |