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BION-2: Predicting Positions of Non-Specifically Bound Ions on Protein Surface by a Gaussian-Based Treatment of Electrostatics

Ions play significant roles in biological processes—they may specifically bind to a protein site or bind non-specifically on its surface. Although the role of specifically bound ions ranges from actively providing structural compactness via coordination of charge–charge interactions to numerous enzy...

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Bibliographic Details
Published in:Int J Mol Sci
Main Authors: Shashikala, H. B. Mihiri, Chakravorty, Arghya, Panday, Shailesh Kumar, Alexov, Emil
Format: Artigo
Language:Inglês
Published: MDPI 2020
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Online Access:https://ncbi.nlm.nih.gov/pmc/articles/PMC7794834/
https://ncbi.nlm.nih.gov/pubmed/33383946
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.3390/ijms22010272
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