PyPLIF HIPPOS and Receptor Ensemble Docking Increase the Prediction Accuracy of the Structure-Based Virtual Screening Protocol Targeting Acetylcholinesterase
In this article, the upgrading process of the structure-based virtual screening (SBVS) protocol targeting acetylcholinesterase (AChE) previously published in 2017 is presented. The upgraded version of PyPLIF called PyPLIF HIPPOS and the receptor ensemble docking (RED) method using AutoDock Vina were...
| Main Authors: | , , , , |
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| Format: | Article |
| Language: | English |
| Published: |
MDPI
2022
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| Subjects: | |
| Online Access: | https://repository.ugm.ac.id/283667/1/42_PyPLIF%20HIPPOS%20and%20Receptor%20Ensemble%20Docking%20Increase%20the%20Prediction%20Accuracy%20of%20the%20Structure-Based%20Virtual%20Screening%20Protocol%20Targeting%20Acetylcholinesterase.pdf |