Acta Pharmaceutica Sinica B
|
2026, 16(7): 4739-4742
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Cryptic pockets in proteins: Harnessing conformational dynamics for rational drug design
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Feiyue Ma1, Shuo Wang1, Chunkyu Ko2, Meehyein Kim2, Peng Zhan1
Affiliations
1 Department of Medicinal Chemistry, Shandong Key Laboratory of Druggability Optimization and Evaluation for Lead Compounds, School of Pharmaceutical Sciences, Shandong University, Jinan 250012, China;
2 Infectious Diseases Therapeutic Research Center, Korea Research Institute of Chemical Technology (KRICT), Daejeon 34114, Republic of Korea
doi: 10.1016/j.apsb.2026.02.007
Outline
Cryptic pockets
/
Rational drug design
/
Molecular dynamics simulations
/
Artificial intelligence
/
Allosteric regulation
Feiyue Ma, Shuo Wang, Chunkyu Ko, Meehyein Kim, Peng Zhan.
Cryptic pockets in proteins: Harnessing conformational dynamics for rational drug design[J].
Acta Pharmaceutica Sinica B,
2026
, 16
(7)
: 4739
-4742
.
DOI: 10.1016/j.apsb.2026.02.007
Year 2026 volume 16 Issue 7
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Article Info
doi: 10.1016/j.apsb.2026.02.007
- Receive Date:2025-08-31
- Online Date:2026-09-17