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Improving protein-ligand docking and screening accuracies by incorporating a scoring function correction term.
Zheng, Liangzhen; Meng, Jintao; Jiang, Kai; Lan, Haidong; Wang, Zechen; Lin, Mingzhi; Li, Weifeng; Guo, Hongwei; Wei, Yanjie; Mu, Yuguang.
  • Zheng L; Shenzhen Institute of Advanced Technology, Chinese Academy of Sciences, Shenzhen, Guangdong 518055, China.
  • Meng J; Shanghai Zelixir Biotech Company Ltd., Shanghai 200030, China.
  • Jiang K; Shenzhen Institute of Advanced Technology, Chinese Academy of Sciences, Shenzhen, Guangdong 518055, China.
  • Lan H; National Supercomputer Center in Shenzhen, Shenzhen, 518000, China.
  • Wang Z; Institute of Plant and Food Science, Department of Biology, School of Life Sciences, Southern University of Science and Technology (SUSTech), Shenzhen, Guangdong 518055, China.
  • Lin M; Tencent AI Lab, Shenzhen, Guangdong 518000, China.
  • Li W; School of Physics, Shandong University, Jinan, Shandong 250101, China.
  • Guo H; Shanghai Zelixir Biotech Company Ltd., Shanghai 200030, China.
  • Wei Y; School of Physics, Shandong University, Jinan, Shandong 250101, China.
  • Mu Y; Institute of Plant and Food Science, Department of Biology, School of Life Sciences, Southern University of Science and Technology (SUSTech), Shenzhen, Guangdong 518055, China.
Brief Bioinform ; 23(3)2022 05 13.
Article en En | MEDLINE | ID: mdl-35289359
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Texto completo: 1 Banco de datos: MEDLINE Asunto principal: Proteínas / Descubrimiento de Drogas Tipo de estudio: Diagnostic_studies / Prognostic_studies / Screening_studies Idioma: En Año: 2022 Tipo del documento: Article
Texto completo
Imprimir
XML
PubMed Links
Search on Google

Texto completo: 1 Banco de datos: MEDLINE Asunto principal: Proteínas / Descubrimiento de Drogas Tipo de estudio: Diagnostic_studies / Prognostic_studies / Screening_studies Idioma: En Año: 2022 Tipo del documento: Article