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Local and Global Breathing Motions Prime the Access to Buried Binding Site in an Antibiotic-Sequestering Protein. [PDF]
Natarajan L +4 more
europepmc +1 more source
One-Size-Fits-All: A Universal Binding Site for Single-Layer Metal Cluster Self-Assembly. [PDF]
Kohlrausch EC +16 more
europepmc +1 more source
Benchmarking Zinc-Binding Site Predictors: A Comparative Analysis of Structure-Based Approaches. [PDF]
Ciofalo C +3 more
europepmc +1 more source
Protein Binding Site Representation in Latent Space. [PDF]
Lohmann F +5 more
europepmc +1 more source
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Journal of Chemical Information and Modeling, 2023
Binding site prediction on protein structures is a crucial step in early phase drug discovery whenever experimental or predicted structure models are involved. DoGSite belongs to the widely used tools for this task.
Joel Graef, C. Ehrt, M. Rarey
semanticscholar +1 more source
Binding site prediction on protein structures is a crucial step in early phase drug discovery whenever experimental or predicted structure models are involved. DoGSite belongs to the widely used tools for this task.
Joel Graef, C. Ehrt, M. Rarey
semanticscholar +1 more source
Binding Site Diversity Promotes CO2 Electroreduction to Ethanol.
Journal of the American Chemical Society, 2019The electrochemical reduction of CO2 has seen many record-setting advances in C2 productivity in recent years. However, the selectivity for ethanol, a globally significant commodity chemical, is still low compared to the selectivity for products such as ...
Yuguang C. Li +14 more
semanticscholar +1 more source

