Application of artificial intelligence techniques for monkeypox: a systematic review

K Chadaga, S Prabhu, N Sampathila, S Nireshwalya… - Diagnostics, 2023 - mdpi.com
Monkeypox or Mpox is an infectious virus predominantly found in Africa. It has spread to
many countries since its latest outbreak. Symptoms such as headaches, chills, and fever are …

Emergence of monkeypox: a worldwide public health crisis

JPS Begum, L Ngangom, P Semwal, S Painuli… - Human Cell, 2023 - Springer
The human monkeypox virus (MPV), a zoonotic illness that was hitherto solely prevalent in
Central and West Africa, has lately been discovered to infect people all over the world and …

Structure-based design of promising natural products to inhibit thymidylate kinase from Monkeypox virus and validation using free energy calculations

A Khan, S Adil, HA Qudsia, Y Waheed… - Computers in Biology …, 2023 - Elsevier
Monkeypox (MPXV) is a globally growing public health concern with 80,328 active cases
and 53 deaths have been reported. No specific vaccine or drug is available for the treatment …

Flavonoids as dual-target inhibitors against α-glucosidase and α-amylase: a systematic review of in vitro studies

TP Lam, NVN Tran, LHD Pham, NVT Lai… - Natural Products and …, 2024 - Springer
Diabetes mellitus remains a major global health issue, and great attention is directed at
natural therapeutics. This systematic review aimed to assess the potential of flavonoids as …

In-silico investigation of E8 surface protein of the monkeypox virus to identify potential therapeutic agents

S Podduturi, D Vemula, S Singothu… - Journal of Biomolecular …, 2024 - Taylor & Francis
The re-emergence of the monkeypox virus (MPXV) in 2022 has become a global issue. The
virus was first found in Denmark in 1958. The first human MPXV disease was reported in …

Exploring Monkeypox: Prospects for therapeutics through computational-aided drug discovery

DB Grajales, S Kar - Molecular Diversity, 2023 - Springer
Monkeypox virus (MPXV) has emerged as a significant public health concern due to its
potential for human transmission and its severe clinical manifestations. This review …

Machine learning and classical MD simulation to identify inhibitors against the P37 envelope protein of monkeypox virus

M Rout, S Dey, S Mishra, S Panda… - Journal of …, 2024 - Taylor & Francis
Monkeypox virus (MPXV) outbreak is a serious public health concern that requires
international attention. P37 of MPXV plays a pivotal role in DNA replication and acts as one …

Computational investigations of potential inhibitors of monkeypox virus envelope protein E8 through molecular docking and molecular dynamics simulations

R Das, A Bhattarai, R Karn, B Tamang - Scientific Reports, 2024 - nature.com
Abstract The World Health Organization (WHO) has declared the monkeypox outbreak a
public health emergency, as there is no specific therapeutics for monkeypox virus (MPXV) …

Trends and Applications in Computationally Driven Drug Repurposing

L Pinzi, G Rastelli - International Journal of Molecular Sciences, 2023 - mdpi.com
Drug repurposing is a widely used approach originally developed to aid in the identification
of new uses of already existing drugs outside the scope of the original medical indication [1] …

In silico approach to identify novel allosteric intracellular antagonist for blocking the interleukin-8/CXCR2 receptor signaling pathway

TTN Tran, QH Tran, CQ Duong… - Journal of …, 2023 - Taylor & Francis
The role of interleukin-8 (IL-8) and its receptor CXCR2 in inflammatory responses and tumor
development and progression has been well documented. Our study aims to discover novel …