Drug repurposing for Mpox: Discovery of small molecules as potential inhibitors against DNA‐dependent RNA polymerase using molecular modeling approach

M Dutt, A Kumar, M Rout, B Dehury… - Journal of Cellular …, 2023 - Wiley Online Library
Mpox (formerly Monkeypox), a zoonotic illness caused by the Mpox virus, belongs to the
Orthopoxvirus genus in the family Poxviridae. To design and develop effective antiviral …

Inhibition potential of natural flavonoids against selected omicron (B. 1.19) mutations in the spike receptor binding domain of SARS-CoV-2: A molecular modeling …

A Kumar, M Dutt, B Dehury… - Journal of …, 2023 - Taylor & Francis
Abstract The omicron (B. 1.19) variant of contagious severe acute respiratory syndrome
coronavirus 2 (SARS-CoV-2), is considered a variant of concern (VOC) due to its increased …

Drug repurposing against main protease and RNA-dependent RNA polymerase of SARS-CoV-2 using molecular docking, MM-GBSA calculations and molecular …

AO Mohammed, MI Abo-Idrees, AA Makki… - Structural Chemistry, 2022 - Springer
A virus called severe acute respiratory distress syndrome coronavirus type 2 (SARS‐CoV‐2)
is the causing organism of coronavirus disease 2019 (COVID-19), which has severely …

Structural insights into the binding of zoledronic acid with RANKL via computational simulations

R Wang, W Zhang, H Ma, D Zou, Z Zhang… - Frontiers in Molecular …, 2022 - frontiersin.org
Zoledronic acid (ZOL) inhibits receptor activator of nuclear factor-κB ligand (RANKL) and
reduces bone turnover. This plays an important role in the development of bisphosphonate …

[HTML][HTML] Formulation of next-generation polyvalent vaccine candidates against three important poxviruses by targeting DNA-dependent RNA polymerase using an …

A Kumar, M Dutt, B Dehury, GS Martinez… - Journal of Infection and …, 2024 - Elsevier
Background Poxviruses comprise a group of large double-stranded DNA viruses and are
known to cause diseases in humans, livestock animals, and other animal species. The Mpox …

A novel range-divided data dependent acquisition strategy for screening of diterpenoid alkaloids in Aconitum pendulum roots

M Deng, B Ren, J Yi, H Ding, H Wang - Journal of Chromatography B, 2025 - Elsevier
A novel range-divided data dependent acquisition (DDA) strategy was proposed for the
screening of diterpenoid alkaloids in Aconitum pendulum roots. In range-divided DDA, the …

[HTML][HTML] Antioxidant and antimicrobial potential of Delphinium denudatum Wall. Evaluated by validated high-performance thin-layer chromatography and in vitro …

NA Siddique - Kuwait Journal of Science, 2025 - Elsevier
Delphinium is a plant with healing properties that can be viewed as a natural source of
antioxidants. This study was conducted to investigate the potential benefits of Delphinium …

Phytocompounds: A Paradigm Shift as Therapeutics for COVID-19

V Prakash, P Bhatia, S Dang, P Gauba… - … Against SARS-CoV-2, 2024 - taylorfrancis.com
Coronavirus disease 2019 (COVID-19) is caused by severe acute respiratory syndrome
coronavirus 2 (SARS-CoV-2) and has resulted in adverse effects worldwide. SARS-CoV-2 …

[HTML][HTML] ПРИРОДНЫЕ СОЕДИНЕНИЯ СЕМЯН СИБИРСКИХ ВИДОВ ACONITUM SPP.

ДВ Аксёнов-Грибанов, ДА Уколов… - Journal of Agriculture …, 2024 - jae.cifra.science
Аннотация Растения рода Aconitum spp. широко используются в народной медицине в
качестве лекарственных средств для лечения различных заболеваний. В состав …