دورية أكاديمية

Obtaining QM/MM binding free energies in the SAMPL8 drugs of abuse challenge: indirect approaches

التفاصيل البيبلوغرافية
العنوان: Obtaining QM/MM binding free energies in the SAMPL8 drugs of abuse challenge: indirect approaches
المؤلفون: Hudson, Phillip S.Aff1, IDs10822022004438_cor1, Aviat, Félix, Meana-Pañeda, Rubén, Warrensford, Luke, Pollard, Benjamin C., Prasad, Samarjeet, Jones, Michael R., Woodcock, H. Lee, Brooks, Bernard R.
المصدر: Journal of Computer-Aided Molecular Design: Incorporating Perspectives in Drug Discovery and Design. 36(4):263-277
قاعدة البيانات: Springer Nature Journals
الوصف
تدمد:0920654X
15734951
DOI:10.1007/s10822-022-00443-8