Rawal RM - Search Results

1

Interactive bioinformatics analysis for the screening of hub genes and molecular docking of phytochemicals present in kitchen spices to inhibit CDK1 in cervical cancer.

Vaghasia H, Sakaria S, Prajapati J, Saraf M, Rawal RM. Vaghasia H, et al. Among authors: rawal rm. Comput Biol Med. 2022 Oct;149:105994. doi: 10.1016/j.compbiomed.2022.105994. Epub 2022 Aug 19. Comput Biol Med. 2022. PMID: 36103746

2

Reckoning a fungal metabolite, Pyranonigrin A as a potential Main protease (M^pro) inhibitor of novel SARS-CoV-2 virus identified using docking and molecular dynamics simulation.

Rao P, Shukla A, Parmar P, Rawal RM, Patel B, Saraf M, Goswami D. Rao P, et al. Among authors: rawal rm. Biophys Chem. 2020 Sep;264:106425. doi: 10.1016/j.bpc.2020.106425. Epub 2020 Jul 6. Biophys Chem. 2020. PMID: 32663708 Free PMC article.

3

Proposing a fungal metabolite-flaviolin as a potential inhibitor of 3CL^pro of novel coronavirus SARS-CoV-2 identified using docking and molecular dynamics.

Rao P, Shukla A, Parmar P, Rawal RM, Patel BV, Saraf M, Goswami D. Rao P, et al. Among authors: rawal rm. J Biomol Struct Dyn. 2022 Jan;40(1):348-360. doi: 10.1080/07391102.2020.1813202. Epub 2020 Sep 2. J Biomol Struct Dyn. 2022. PMID: 32875950

4

Identifying structural-functional analogue of GRL0617, the only well-established inhibitor for papain-like protease (PLpro) of SARS-CoV2 from the pool of fungal metabolites using docking and molecular dynamics simulation.

Rao P, Patel R, Shukla A, Parmar P, Rawal RM, Saraf M, Goswami D. Rao P, et al. Among authors: rawal rm. Mol Divers. 2022 Feb;26(1):309-329. doi: 10.1007/s11030-021-10220-8. Epub 2021 Apr 6. Mol Divers. 2022. PMID: 33825097 Free PMC article.

5

Meticulous assessment of natural compounds from NPASS database for identifying analogue of GRL0617, the only known inhibitor for SARS-CoV2 papain-like protease (PLpro) using rigorous computational workflow.

Parmar P, Rao P, Sharma A, Shukla A, Rawal RM, Saraf M, Patel BV, Goswami D. Parmar P, et al. Among authors: rawal rm. Mol Divers. 2022 Feb;26(1):389-407. doi: 10.1007/s11030-021-10233-3. Epub 2021 May 18. Mol Divers. 2022. PMID: 34008129 Free PMC article.

6

Sterenin M as a potential inhibitor of SARS-CoV-2 main protease identified from MeFSAT database using molecular docking, molecular dynamics simulation and binding free energy calculation.

Prajapati J, Patel R, Goswami D, Saraf M, Rawal RM. Prajapati J, et al. Among authors: rawal rm. Comput Biol Med. 2021 Aug;135:104568. doi: 10.1016/j.compbiomed.2021.104568. Epub 2021 Jun 12. Comput Biol Med. 2021. PMID: 34174757 Free PMC article.

7

Identifying potential human and medicinal plant microRNAs against SARS-CoV-2 3'UTR region: A computational genomics assessment.

Mangukia N, Rao P, Patel K, Pandya H, Rawal RM. Mangukia N, et al. Among authors: rawal rm. Comput Biol Med. 2021 Sep;136:104662. doi: 10.1016/j.compbiomed.2021.104662. Epub 2021 Jul 19. Comput Biol Med. 2021. PMID: 34311261 Free PMC article.

8

Repurposing the antibacterial drugs for inhibition of SARS-CoV2-PLpro using molecular docking, MD simulation and binding energy calculation.

Patel R, Prajapati J, Rao P, Rawal RM, Saraf M, Goswami D. Patel R, et al. Among authors: rawal rm. Mol Divers. 2022 Aug;26(4):2189-2209. doi: 10.1007/s11030-021-10325-0. Epub 2021 Sep 30. Mol Divers. 2022. PMID: 34591234 Free PMC article.

9

Unravelling the antifungal mode of action of curcumin by potential inhibition of CYP51B: A computational study validated in vitro on mucormycosis agent, Rhizopus oryzae.

Prajapati J, Rao P, Poojara L, Goswami D, Acharya D, Patel SK, Rawal RM. Prajapati J, et al. Among authors: rawal rm. Arch Biochem Biophys. 2021 Nov 15;712:109048. doi: 10.1016/j.abb.2021.109048. Epub 2021 Sep 30. Arch Biochem Biophys. 2021. PMID: 34600893

10

Endophytic fungi: A treasure trove of novel anticancer compounds.

Prajapati J, Goswami D, Rawal RM. Prajapati J, et al. Among authors: rawal rm. Curr Res Pharmacol Drug Discov. 2021 Sep 1;2:100050. doi: 10.1016/j.crphar.2021.100050. eCollection 2021. Curr Res Pharmacol Drug Discov. 2021. PMID: 34909676 Free PMC article.

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