biblio

Found 13 results
Filters: Keyword is docking  [Clear All Filters]
2023
C. L. Meena, Hingamire, T., Gupta, T., Deshmukh, B., Karmodiya, K., Joshi, R., Shanmugam, D., and Sanjayan, G. J., “Histidinal-based potent antimalarial agents”, ChemMedChem, vol. 18, no. 9, 2023.
2022
N. V. Puranik, Swami, S., Misar, A. V., Mamgain, R., Gulawani, S. S., Dhiman, S., and Srivastava, P., “First synthesis of podocarflavone A and its analogs and evaluation of their antimycobacterial potential against mycobacterium tuberculosis with the support of virtual screening”, Natural Product Research, vol. 36, no. 15, pp. 3879-3886, 2022.
R. Ben Ayed, Moreau, F., Ben Hlima, H., Rebai, A., Ercisli, S., Kadoo, N., Hanana, M., Assouguem, A., Ullah, R., and Ali, E. A., “SNP discovery and structural insights into OeFAD2 unravelling high oleic/linoleic ratio in olive oil”, Computational and Structural Biotechnology Journal, vol. 20, pp. 1229-1243, 2022.
2021
N. Gujar, ,, Joshi, R. S., and Joshi, M., “Molecular characterization of the beta(2)-like octopamine receptor of helicoverpa armigera”, Journal of Membrane Biology, vol. 254, no. 3, 2021.
P. Prakash, Vijayasarathi, D., Selvam, K., Karthi, S., and Manivasagaperumal, R., “Pharmacore maping based on docking, ADME/toxicity, virtual screening on 3,5-dimethyl-1,3,4-hexanetriol and dodecanoic acid derivates for anticancer inhibitors”, Journal of Biomolecular Structure & Dynamics, vol. 39, no. 12, pp. 4490-4500, 2021.
2016
P. Yadav, Shahane, G., Ramasamy, S., Sengupta, D., and Gaikwad, S., “Structural-functional insights and studies on saccharide binding of Sophora japonica seed lectin”, International Journal of Biological Macromolecules, vol. 91, pp. 75-84, 2016.
T. S. Chitre, Asgaonkar, K. D., Miniyar, P. B., Dharme, A. B., Arkile, M. A., Yeware, A., Sarkar, D., Khedkar, V. M., and Jha, P. C., “Synthesis and docking studies of pyrazine-thiazolidinone hybrid scaffold targeting dormant tuberculosis”, Bioorganic & Medicinal Chemistry Letters, vol. 26, no. 9, pp. 2224-2228, 2016.
S. Dharni, Sanchita,, Unni, S. K. M., Kurungot, S., Samad, A., Sharma, A., and Patra, D. Dhar, “Vitro and in silico antifungal efficacy of nitrogen- doped carbon nanohorn ( NCNH) against rhizoctonia solani”, Journal of Biomolecular Structure & Dynamics, vol. 34, no. 1, pp. 152-162, 2016.
2015
R. Vyas, Karthikeyan, M., Nainaru, G., and Muthukrishnan, M., “Pharmacophore and docking based virtual screening of validated mycobacterium tuberculosis targets”, Combinatorial Chemistry & High Throughput Screening, vol. 18, no. 7, pp. 624-637, 2015.
2013
R. P. Samal, Khedkar, V. M., Pissurlenkar, R. R. S., Bwalya, A. Gono, Tasdemir, D., Joshi, R. A., Rajamohanan, P. R., Puranik, V. G., and Coutinho, E. C., “Design, synthesis, structural characterization by IR, 1H, 13C, 15N, 2D-NMR, X-ray diffraction and evaluation of a new class of phenylaminoacetic acid benzylidene hydrazines as pfENR inhibitors”, Chemical Biology & Drug Design, vol. 81, no. 6, pp. 715-729, 2013.
V. Sunder Avinash, Panigrahi, P., Suresh, C. G., Pundle, A. V., and Ramasamy, S., “Structural modelling of substrate binding and inhibition in penicillin V acylase from pectobacterium atrosepticum”, Biochemical and Biophysical Research Communications, vol. 437, no. 4, pp. 538-543, 2013.
2012
M. Sajid Khan, Akhtar, S., Siddiqui, S. A., Siddiqui, M. S., Srinivasan, K. V., and Arif, J. M., “Design, synthesis and evaluation of unique 2,4,5-triaryl imidazole derivatives as novel potent aspartic protease inhibitors”, Medicinal Chemistry, vol. 8, no. 3, pp. 428-435, 2012.
2009
N. Sekhar Pagadala, Arha, M., Reddy, P. S., Kumar, R., Sirisha, V. L., Prashant, S., K. Reddy, J., Khan, B. Mohammad, Rawal, S. K., and Kishor, P. B. Kavi, “Phylogenetic analysis, homology modelling, molecular dynamics and docking studies of caffeoyl-CoA-O- methyl transferase (CCoAOMT 1 and 2) isoforms isolated from subabul (Leucaena leucocephala)”, Journal of Molecular Modeling, vol. 15, no. 2, pp. 203-221, 2009.