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Assessing the performance of the MM/PBSA and MM/GBSA methods. 10. Impacts of enhanced sampling and variable dielectric model on protein-protein Interactions.
Wang, Ercheng; Weng, Gaoqi; Sun, Huiyong; Du, Hongyan; Zhu, Feng; Chen, Fu; Wang, Zhe; Hou, Tingjun.
Affiliation
  • Wang E; Hangzhou Institute of Innovative Medicine, College of Pharmaceutical Sciences, Zhejiang University, Hangzhou, Zhejiang 310058, China. tingjunhou@zju.edu.cn.
  • Weng G; Hangzhou Institute of Innovative Medicine, College of Pharmaceutical Sciences, Zhejiang University, Hangzhou, Zhejiang 310058, China. tingjunhou@zju.edu.cn.
  • Sun H; Hangzhou Institute of Innovative Medicine, College of Pharmaceutical Sciences, Zhejiang University, Hangzhou, Zhejiang 310058, China. tingjunhou@zju.edu.cn.
  • Du H; Hangzhou Institute of Innovative Medicine, College of Pharmaceutical Sciences, Zhejiang University, Hangzhou, Zhejiang 310058, China. tingjunhou@zju.edu.cn.
  • Zhu F; Hangzhou Institute of Innovative Medicine, College of Pharmaceutical Sciences, Zhejiang University, Hangzhou, Zhejiang 310058, China. tingjunhou@zju.edu.cn.
  • Chen F; Hangzhou Institute of Innovative Medicine, College of Pharmaceutical Sciences, Zhejiang University, Hangzhou, Zhejiang 310058, China. tingjunhou@zju.edu.cn.
  • Wang Z; Hangzhou Institute of Innovative Medicine, College of Pharmaceutical Sciences, Zhejiang University, Hangzhou, Zhejiang 310058, China. tingjunhou@zju.edu.cn.
  • Hou T; Hangzhou Institute of Innovative Medicine, College of Pharmaceutical Sciences, Zhejiang University, Hangzhou, Zhejiang 310058, China. tingjunhou@zju.edu.cn and State Key Lab of CAD&CG, Zhejiang University, Hangzhou, Zhejiang 310058, China.
Phys Chem Chem Phys ; 21(35): 18958-18969, 2019 Sep 21.
Article in En | MEDLINE | ID: mdl-31453590
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Full text: 1 Collection: 01-internacional Database: MEDLINE Main subject: Proteins / Chemistry Techniques, Analytical / Models, Chemical Type of study: Prognostic_studies Language: En Journal: Phys Chem Chem Phys Journal subject: BIOFISICA / QUIMICA Year: 2019 Document type: Article Affiliation country: China Country of publication: United kingdom
Fulltext
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Full text: 1 Collection: 01-internacional Database: MEDLINE Main subject: Proteins / Chemistry Techniques, Analytical / Models, Chemical Type of study: Prognostic_studies Language: En Journal: Phys Chem Chem Phys Journal subject: BIOFISICA / QUIMICA Year: 2019 Document type: Article Affiliation country: China Country of publication: United kingdom