Item Infomation
Title: | Design of new reversible and selective inhibitors of monoamine oxidase A and a comparison with drugs already approved |
Authors: | Reyes-Chaparro, A. |
Participants: | Lopez, N. S. Flores- Guerrero, F. Quintanilla- Nicolás-Álvarez, Dulce Estefanía Hernandez-Martinez, A. R. |
Issue Date: | 2023 |
Series/Report no.: | Bulletin of the National Research Centre, Volume 47 (2023), Article number: 46 |
Abstract: | A total of 10,100 chalcone-derived molecules were obtained (Additional files 1, 2, and 3); then different screening techniques were used for physicochemical properties, molecular docking, molecular dynamics, and DFT calculations to select the best candidates. Drugs used as MAO-A inhibitors were evaluated as a reference comparison. |
URI: | http://tailieuso.tlu.edu.vn/handle/DHTL/12909 |
Source: | https://link.springer.com/article/10.1186/s42269-023-01018-9 |
ISSN: | 2522-8307 |
Appears in Collections: | Tài liệu mở |
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