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Conformational free energy modeling of druglike molecules by metadynamics in the WHIM space |
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| Authors: | Spiwok Vojtěch Hlat-Glembová Katarína Tvaroška Igor Králová Blanka |
| Affiliation: | Department of Biochemistry and Microbiology, Institute of Chemical Technology Prague, Technická 3, Prague 6, 166 28, Czech Republic. spiwokv@vscht.cz |
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| 本文献已被 PubMed 等数据库收录！ | |