Molecular docking and molecular dynamics simulation of Bacillus thuringiensis dehalogenase against haloacids, haloacetates and chlorpyrifos
The high dependency and surplus use of agrochemical products have liberated enormous quantities of toxic halogenated pollutants into the environment and threaten the well-being of humankind. Herein, this study performed molecular docking, molecular dynamic (MD) simulations, molecular mechanics-Poiss...
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| Main Authors: | , , |
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| Format: | Article |
| Published: |
Taylor and Francis Ltd.
2022
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| Subjects: | |
| Online Access: | http://eprints.utm.my/id/eprint/102910/ http://dx.doi.org/10.1080/07391102.2020.1835727 |
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