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Predicting Protein-Ligand Binding Modes for CELPP and GC3: Workflows and Insight

Drug Design Data Resource (D3R) continues to release valuable benchmarking datasets to promote improvement and development of computational methods for new drug discovery. We have developed several methods for protein-ligand binding mode prediction during the participation in the D3R challenges. In...

Täydet tiedot

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Bibliografiset tiedot
Julkaisussa:J Comput Aided Mol Des
Päätekijät: Xu, Xianjin, Ma, Zhiwei, Duan, Rui, Zou, Xiaoqin
Aineistotyyppi: Artigo
Kieli:Inglês
Julkaistu: 2019
Aiheet:
Linkit:https://ncbi.nlm.nih.gov/pmc/articles/PMC6494980/
https://ncbi.nlm.nih.gov/pubmed/30689079
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1007/s10822-019-00185-0
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