<p>Pharmacoinformatics, virtual screening, and molecular dynamics simulation towards identification of inhibitors against human pathogenic Lujo-Virus 6GH8 target</p>

Mohammed Emon; Jovel Varghese - Jose; Eshaan  Agarwal; Mosadoluwa  Agbonyin; Sanjana  Fatema Chowdhury; Karthika R; Ayush Panda; Ayesha  Saman Hawaldar; Jaskeerat Singh; Hameed  Sanusi; Emmanuel Ifeanyi Attah; Siddhant Sharma; Maurya Sharma; Anjali Sharma

doi:10.7490/f1000research.1118864.1

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Emon M, Varghese - Jose J, Agarwal E et al. Pharmacoinformatics, virtual screening, and molecular dynamics simulation towards identification of inhibitors against human pathogenic Lujo-Virus 6GH8 target [version 1; not peer reviewed]. F1000Research 2021, 10(ISCB Comm J):1202 (poster) (https://doi.org/10.7490/f1000research.1118864.1)

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Pharmacoinformatics, virtual screening, and molecular dynamics simulation towards identification of inhibitors against human pathogenic Lujo-Virus 6GH8 target

Mohammed Emon¹, Jovel Varghese - Jose², Eshaan Agarwal³, Mosadoluwa Agbonyin⁴, Sanjana Fatema Chowdhury⁵, Karthika R⁶, Ayush Panda⁷, Ayesha Saman Hawaldar⁸, Jaskeerat Singh⁹, Hameed Sanusi¹⁰, Emmanuel Ifeanyi Attah¹¹, Siddhant Sharma³, Maurya Sharma¹², Anjali Sharma³

Published 25 Nov 2021 (https://doi.org/10.7490/f1000research.1118864.1)

Author Affiliations

¹ Department of Biotechnology, BSMRST University, Bangladesh
² Department of Biotechnology, Amity University, India
³ Department of Biochemistry, Deshbandhu College, University of Delhi, India
⁴ Department of Physiology, Babcock University, Nigeria
⁵ Department of Genetic Engineering, SUST, Bangladesh
⁶ Center for Biotechnology, Anna University, India
⁷ School of Biological Sciences, National Institute of Science Education and Research, India
⁸ Department of Biotechnology, The University of Melbourne, Australia
⁹ Department of Biology, University of Western Ontario, Canada
¹⁰ Department of Cell Biology, University of Lagos, Nigeria
¹¹ Department of Pharmaceutical and Medicinal Chemistry, University of Nigeria, Nigeria
¹² Department of Biochemistry, Shivaji College, University of Delhi, India

Copyright © 2021 Emon M et al. This is an open access work distributed under the terms of the Creative Commons Attribution License, which permits unrestricted use, distribution, and reproduction in any medium, provided the original work is properly cited.

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Published 25 Nov 2021

Pharmacoinformatics, virtual screening, and molecular dynamics simulation towards identification of inhibitors against human pathogenic Lujo-Virus 6GH8 target
[version 1; not peer reviewed]

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Bioinformatics and Computational Biology Conference 2021

Abstract

Competing Interests

No competing interests were disclosed

Keywords

Computer-Aided Drug Development, CADD, Lujo Hemorrhagic Fever Virus, Virtual Screening, ADMET, Molecular Interactions, Molecular Docking, Molecular Dynamic Simulations, Small Molecules

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