Vijayan RS - Search Results

1

Phenyl substituted 3-hydroxypyridin-2(1H)-ones: inhibitors of influenza A endonuclease.

Parhi AK, Xiang A, Bauman JD, Patel D, Vijayan RS, Das K, Arnold E, Lavoie EJ. Parhi AK, et al. Among authors: vijayan rs. Bioorg Med Chem. 2013 Nov 1;21(21):6435-46. doi: 10.1016/j.bmc.2013.08.053. Epub 2013 Sep 4. Bioorg Med Chem. 2013. PMID: 24055080

2

Detecting allosteric sites of HIV-1 reverse transcriptase by X-ray crystallographic fragment screening.

Bauman JD, Patel D, Dharia C, Fromer MW, Ahmed S, Frenkel Y, Vijayan RS, Eck JT, Ho WC, Das K, Shatkin AJ, Arnold E. Bauman JD, et al. Among authors: vijayan rs. J Med Chem. 2013 Apr 11;56(7):2738-46. doi: 10.1021/jm301271j. Epub 2013 Feb 20. J Med Chem. 2013. PMID: 23342998 Free PMC article.

3

Crystallographic fragment screening and structure-based optimization yields a new class of influenza endonuclease inhibitors.

Bauman JD, Patel D, Baker SF, Vijayan RS, Xiang A, Parhi AK, Martínez-Sobrido L, LaVoie EJ, Das K, Arnold E. Bauman JD, et al. Among authors: vijayan rs. ACS Chem Biol. 2013 Nov 15;8(11):2501-8. doi: 10.1021/cb400400j. Epub 2013 Sep 13. ACS Chem Biol. 2013. PMID: 23978130 Free PMC article.

4

3-Hydroxyquinolin-2(1H)-ones As Inhibitors of Influenza A Endonuclease.

Sagong HY, Parhi A, Bauman JD, Patel D, Vijayan RS, Das K, Arnold E, LaVoie EJ. Sagong HY, et al. Among authors: vijayan rs. ACS Med Chem Lett. 2013 May 7;4(6):547-50. doi: 10.1021/ml4001112. eCollection 2013 Jun 13. ACS Med Chem Lett. 2013. PMID: 24936242 Free PMC article.

5

Molecular dynamics study of HIV-1 RT-DNA-nevirapine complexes explains NNRTI inhibition and resistance by connection mutations.

Vijayan RS, Arnold E, Das K. Vijayan RS, et al. Proteins. 2014 May;82(5):815-29. doi: 10.1002/prot.24460. Epub 2013 Nov 22. Proteins. 2014. PMID: 24174331 Free PMC article.

6

Conformational analysis of the DFG-out kinase motif and biochemical profiling of structurally validated type II inhibitors.

Vijayan RS, He P, Modi V, Duong-Ly KC, Ma H, Peterson JR, Dunbrack RL Jr, Levy RM. Vijayan RS, et al. J Med Chem. 2015 Jan 8;58(1):466-79. doi: 10.1021/jm501603h. Epub 2014 Dec 12. J Med Chem. 2015. PMID: 25478866 Free PMC article.

7

Crystal structure of O-Acetylserine sulfhydralase (OASS) isoform 3 from Entamoeba histolytica: Pharmacophore-based virtual screening and validation of novel inhibitors.

Dharavath S, Vijayan R, Kumari K, Tomar P, Gourinath S. Dharavath S, et al. Eur J Med Chem. 2020 Apr 15;192:112157. doi: 10.1016/j.ejmech.2020.112157. Epub 2020 Feb 19. Eur J Med Chem. 2020. PMID: 32145643

8

Distinguishing binders from false positives by free energy calculations: fragment screening against the flap site of HIV protease.

Deng N, Forli S, He P, Perryman A, Wickstrom L, Vijayan RS, Tiefenbrunn T, Stout D, Gallicchio E, Olson AJ, Levy RM. Deng N, et al. Among authors: vijayan rs. J Phys Chem B. 2015 Jan 22;119(3):976-88. doi: 10.1021/jp506376z. Epub 2014 Sep 17. J Phys Chem B. 2015. PMID: 25189630 Free PMC article.

9

Hybrid structure-based virtual screening protocol for the identification of novel BACE1 inhibitors.

Vijayan RS, Prabu M, Mascarenhas NM, Ghoshal N. Vijayan RS, et al. J Chem Inf Model. 2009 Mar;49(3):647-57. doi: 10.1021/ci800386v. J Chem Inf Model. 2009. PMID: 19434899

10

Large scale free energy calculations for blind predictions of protein-ligand binding: the D3R Grand Challenge 2015.

Deng N, Flynn WF, Xia J, Vijayan RS, Zhang B, He P, Mentes A, Gallicchio E, Levy RM. Deng N, et al. Among authors: vijayan rs. J Comput Aided Mol Des. 2016 Sep;30(9):743-751. doi: 10.1007/s10822-016-9952-x. Epub 2016 Aug 25. J Comput Aided Mol Des. 2016. PMID: 27562018 Free PMC article.

Save citations to file

Email citations

Send citations to clipboard

Add to Collections

Add to My Bibliography

Create a file for external citation management software

Your saved search

Your RSS Feed

My Custom Filters

Publication date

Text availability

Article attribute

Article type

Article Language

Species

Sex

Age

Other

45 results

Search Page

Filters