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IChem: A Versatile Toolkit for Detecting, Comparing, and Predicting Protein–Ligand Interactions
Structure‐based ligand design requires an exact description of the topology of molecular entities under scrutiny. IChem is a software package that reflects the many contributions of our research group in this area over the last decade. It facilitates and automates many tasks (e.g., ligand/cofactor a...
Autores principales: | , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
John Wiley and Sons Inc.
2017
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5901026/ https://www.ncbi.nlm.nih.gov/pubmed/29024463 http://dx.doi.org/10.1002/cmdc.201700505 |