Assessing the performance of docking, FEP, and MM/GBSA methods on a series of KLK6 inhibitors.
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| Title: | Assessing the performance of docking, FEP, and MM/GBSA methods on a series of KLK6 inhibitors. |
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| Authors: | Lima Silva, Wemenes José1, Ferreira de Freitas, Renato1, renato.f@ufabc.edu.br |
| Source: | Journal of Computer-Aided Molecular Design; Sep2023, Vol. 37 Issue 9, p407-418, 12p |
| Database: | Applied Science & Technology Source |
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| ISSN: | 0920654X |
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| DOI: | 10.1007/s10822-023-00515-3 |
