MACROMOLECULAR AND CHEMICAL CRYSTALLOGRAPHY LAB

Publications

2024
  • Priya, Bhanu, Delna Johnson, Gurudutt Dubey, Divita Suthar, Indracanti Prem Kumar, Vijay Thiruvenkatam, and Sivapriya Kirubakaran. "Temozolomide cocrystal forms with enhanced dissolution, stability and biological activity towards Glioblastoma." Journal of Molecular Structure : 138751, 2024. DOI: https://doi.org/10.1016/j.molstruc.2024.138751 
  • Dilip, Haritha, Vijay Thiruvenkatam, and Sivapriya Kirubakaran. "Studies on Methylpyrazole-Substituted Benzimidazoles to Target Helicobacter pylori Infection through Hp IMPDH Inhibition." ACS Infectious Diseases, 2024. DOI:https://doi.org/10.1021/acsinfecdis.4c00228 
  • Shah, Sakshi M., Soumalya Chakraborty, Gurudutt Dubey, Suhas Yewale, Rohit Y. Sathe, L. Ramaswamy, Samir Haddouchi, Vijay Thiruvenkatam, Prasad V. Bharatam, and Arvind K. Bansal. "Effect of Differential Surface Anisotropy on Dissolution Behavior of Fenofibrate Crystal Habits: Comparative Study using USP Type 2 and Type 4 Dissolution Apparatuses." Journal of Pharmaceutical Sciences, 2024. DOI: https://doi.org/10.1016/j.xphs.2024.02.001 
2023
  • Sivadas, Deepanjaly K.; Ravi, Sasikala; Nagarasu, Palaniyappan; George, Johnson Delna J. K.; Thiruvenkatam, Vijay; Anthony, Savarimuthu Philip and Madhu, Vedichi, “Fluorophore unit controlled photoswitching of hydrazone derivatives: reversible and irreversible off-on/dual-color fluorescence photoswitches”, Molecular Systems Design & Engineering, Jul. 2023. DOI: https://doi.org/10.1039/D3ME00093A
  • Singh, Surendra V.; Jayaram, V.; Meka, Jaya K.; Thiruvenkatam, Vijay; Vijayan, S.; Bhardwaj, Anil; Burchell, M. J.; Mason, N. J. and Sivaraman, B., “Extraterrestrial impacts creating architectures for life”, Journal of the Indian Institute of Science, Jul. 2023. DOI: 10.1007/s41745-023-00397-2
  • Shaik, Althaf; Bhagwat, Pranav; Palanisamy, Parimaladevi; Chhabria, Dimple; Dubey, Pankaj; Kirubakaran, Sivapriya and Thiruvenkatam, Vijay, “Novel pharmaceutical co-crystals of gefitinib: synthesis, dissolution, cytotoxicity, and theoretical studies”, CrystEngComm, DOI: 10.1039/D3CE00056G, vol. 25, no. 17, pp. 2570-2581, Mar. 2023.
  • George, Johnson Delna J. K.; Hussain, Javeena; Bhoir, Siddhant; Chandrasekaran, Vaishali; Sahrawat, Parul; Hans, Tanya; Khalil, Md Imtiaz; Benedetti, Arrigo De; Thiruvenkatam, Vijay and Kirubakaran, Sivapriya, “Synthesis, kinetics and cellular studies of new phenothiazine analogs as potent human-TLK inhibitors”, Organic & Biomolecular Chemistry, DOI: 10.1039/D2OB02191A, vol. 21, no. 9, pp. 1980-1991, Jan. 2023.
  • Dahiwadkar, Rahul; Murugan, Arumugavel; George, Johnson Delna J. K.; Chakraborty, Rik; Thiruvenkatam, Vijay and Kanvah, Sriram, “Functional organogel with α-cyanostilbene scaffold: aggregation enhanced emission and picric acid sensing”, Journal of Photochemistry and Photobiology A: Chemistry, DOI: 10.1016/j.jphotochem.2022.114227, vol. 434, Jan. 2023.
  • Dahiwadkar, Rahul; Dubey, Gurudutt; Shaik, Althaf; Jana, Palash; Thiruvenkatam, Vijay and Kanvah, Sriram, “Halogen-bonded co-crystals with AIE active alpha-cyanostilbenes”, New Journal of Chemistry, DOI: 10.1039/D3NJ00333G, vol. 47, no. 24, pp. 11685-11696, May 2023.
  • Angira, Deekshi; Chaudhary, Sonali; Abiramasundari, Arumugam and Thiruvenkatam, Vijay, “To explore the binding affinity of human γ-secretase activating protein (GSAP) isoform 4 with APP-C99 peptides”, ACS Omega, DOI: 10.1021/acsomega.3c01117, vol. 8, no. 14, pp. 13435-13443, Apr. 2023.
2022
  • George, Johnson Delna J. K.; Hussain, Javeena; Bhoir, Siddhant; Sahsrawat, Parul; Hans, Tanya; Vaishali, C.; Thiruvenkatam, Vijay and Kirubakaran, Sivapriya, “Evaluating the therapeutic viability of bacterially expressed human TLK1B-kinase domain for cancer drug design”, Research Square, Research Square Company, DOI: 10.21203/rs.3.rs-1314176/v1, Feb. 2022.
  • Singh, Surendra Vikram; Jayaram, V.; Meka, J. K.; Muruganantham, M.; Thiruvenkatam, Vijay; Vijayan, S.; Rajsekhar, B. N.; Bhardwaj, A.; Mason, N. J. and Sivaraman, B., “Three-dimensional complex architectures observed in shock processed amino acid mixtures”, Experimental Results, DOI: 10.1017/exp.2021.17, vol. 3, Feb. 2022.
  • Singh, Surendra Vikram; Dilip, Haritha; Meka, Jaya K.; Thiruvenkatam, Vijay; Jayaram, Vishakantaiah; Muruganantham, Mariyappan; Sivaprahasam, Vijayan; Rajasekhar, Balabhadrapatruni N.; Bhardwaj, Anil; Mason, Nigel J.; Burchell, Mark J. and Sivaraman, Bhalamurugan, “New signatures of bio-molecular complexity in the hypervelocity impact ejecta of icy moon analogues”, Life, DOI: 10.3390/life12040508, vol. 12, no. 4, Mar. 2022.
  • Roy, Arijit; Singh, Surendra Vikram; Meka, J. K.; Ramachandran, R.; Sahu, D.; Gautam, Abhay Raj Singh; Thiruvenkatam, Vijay; Jayaram, V.; Janardhan, P.; Rajasekhar, B. N.; Bhardwaj, Anil; Mason, N. J. and Sivaraman, B., “Shock induced transformation of non-magnetic to magnetic ISM dust analogue”, Monthly Notices of the Royal Astronomical Society, DOI: 10.1093/mnras/stac2637, vol. 517, no. 4, pp. 4845-4855, Dec. 2022.
  • Ovais Dar, Mohammad; Kapse, Rahul Y.; Dubey, Gurudutt; Singh, Tejender; Thiruvenkatam, Vijay and Bharatam, Prasad V., “Electronic structure analysis and synthesis of Nitroso N-Heterocyclic Imines”, ChemistrySelect, DOI: 10.1002/slct.202203613, vol. 7, no. 43, Nov. 2022.
  • Hussain, Javeena; Sahrawat, Parul; Dubey, Pankaj; Kirubakaran, Sivapriya and Thiruvenkatam, Vijay, “Exploring packing features of N-substituted acridone derivatives: synthesis and X-ray crystallography studies”, Journal of Molecular Structure, DOI: 10.1016/j.molstruc.2021.131448, vol. 1248, Jan. 2022.
  • Dilip, Haritha; Purushothaman, Gayathri; Sharma, Gaurav; Menon, Aishwarya; Thiruvenkatam, Vijay and Kirubakaran, Sivapriya, “Mutants of helicobacter pylori IMPDH: kinetics and in silico studies to determine the structural and functional role of key amino acids”, Chemistry: An Asian Journal, DOI: 10.1002/asia.202200125, Mar. 2022.
2021
  • Surendra, V. S.; Jayaram, V.; Muruganantham, M.; Thiruvenkatam, Vijay; Vijayan, S.; Samarth, P.; Hill, H.; Bhardwaj, Anil; Mason, N. J.; Sivaraman, B., “Complex structures synthesized in shock processing of nucleobases–implications to the origins of life”, International Journal of Astrobiology, DOI: 10.1017/S1473550421000136, vol. 20, no. 4, pp. 285-293, Aug. 2021.
  • Ravi, Srimadhavi; Priya, Bhanu; Dubey, Pankaj; Thiruvenkatam, Vijay and Kirubakaran, Sivapriya, “Molecular docking and molecular dynamics simulation studies of quinoline-3-carboxamide derivatives with DDR kinases–selectivity studies towards ATM kinase”, Chemistry, DOI: 10.3390/chemistry3020036, vol. 3, no. 2, pp. 511-524, Apr. 2021.
  • Parwani, Kirti; Patel, Farhin; Bhagwat, Pranav; Dilip, Haritha; Patel, Dhara; Thiruvenkatam, Vijay and Mandal, Palash, “Swertiamarin mitigates nephropathy in high-fat diet/streptozotocin-induced diabetic rats by inhibiting the formation of advanced glycation end products”, Archives of Physiology and Biochemistry, DOI: 10.1080/13813455.2021.1987478, Oct. 2021.
  • Nagarasu, Palaniyappan; Kundu, Anu; Thiruvenkatam, Vijay; Raghavaiah, Pallepogu; Anthony, Savarimuthu Philip; Madhu, Vedichi, “Investigating the structure–fluorescence properties of tetraphenylethylene fused imidazole AIEgens: reversible mechanofluorochromism and polymer matrix controlled fluorescence tuning”, CrystEngComm, DOI: 10.1039/D1CE00561H, vol. 23, no. 31, pp. 5403-5410, Jun. 2021.
  • Mahapatra, Amarjyoti Das; Shaik, Althaf; Thiruvenkatam, Vijay and Datta, Bhaskar, “Supramolecular architecture in sulfonylurea, sulfonyldiurea and sulfonyltriurea drugs: synthesis, X-ray structure and Hirshfeld surface analysis”, Journal of Molecular Structure, DOI: 10.1016/j.molstruc.2021.130158, vol. 1233, Feb. 2021.
  • Al-Wahaibi, Lamya H.; Shaik, Althaf; Elmorsy, Mohammed A.; Abdelbaky, Mohammed S. M.; Garcia-Granda, Santiago; Thamotharan, Subbiah; Thiruvenkatam, Vijay and El-Emam, Ali A., “Structural insights of three 2,4-disubstituted dihydropyrimidine-5-carbonitriles as potential dihydrofolate reductase inhibitors”, Molecules, DOI: 10.3390/molecules26113286, vol. 26, no. 11, May 2021.
2020
  • Angira, Deekshi; Natarajan, Nalini; Dedania, Samir R.; Patel, Darshan H. and Thiruvenkatam, Vijay, “Characterization of P. aeruginosa glucose 6- phosphate isomerase: a functional insight via in-vitro activity study”, Current Topics in Medicinal Chemistry, DOI: 10.2174/1568026620666200820153751, vol. 20, no. 29, pp. 2651-2661, Aug. 2020.
  • Angira, Deekshi; Shaik, Althaf and Thiruvenkatam, Vijay, “Structural and strategic landscape of PIKK protein family and their inhibitors: an overview”, Frontiers in Bioscience, Landmark Edition, DOI: 10.2741/4867, vol. 25, no. 8, pp. 1538-1567, Mar. 2020.
  • Hussain, Javeena; Angira, Deekshi; Hans, Tanya; Dubey, Pankaj; Kirubakaran, Sivapriya and Thiruvenkatam, Vijay, “Synthesis and characterization of a new class of phenothiazine molecules with 10H-substituted morpholine & piperidine derivatives: a structural insight”, Journal of Molecular Structure, DOI: 10.1016/j.molstruc.2020.128546, vol. 1219, Jun. 2020.
  • Natarajan, Nalini; Shaik, Althaf and Thiruvenkatam, Vijay, “Recombinant tumor suppressor TSC1 differentially interacts with Escherichia coli DnaK and human HSP70”, ACS Omega, DOI: 10.1021/acsomega.0c02480, vol. 5, no. 30, pp. 19131-19139, Jul. 2020.
  • Natarajan, Nalini and Thiruvenkatam, Vijay, “An insight of scientific developments in TSC for better therapeutic strategy”, Current Topics in Medicinal Chemistry, DOI: 10.2174/1568026620666200825170355, vol. 20, no. 23, pp. 2080-2093, Aug. 2020.
  • Shaik, Althaf; Palaniswamy, Parimaladevi and Thiruvenkatam, Vijay, “Investigating structural aspects of pyridopyrimidinone derivatives, an important precursor in medicinal chemistry”, Journal of Molecular Structure, DOI: 10.1016/j.molstruc.2020.129040, vol. 1224, Aug. 2020.
  • Singh, Surendra V.; Vishakantaiah, Jayaram; Meka, Jaya K.; Sivaprahasam, Vijayan; Chandrasekaran, Vijayanand; Thombre, Rebecca; Thiruvenkatam, Vijay; Mallya, Ambresh; Rajasekhar, Balabhadrapatruni N.; Muruganantham, Mariyappan; Datey, Akshay; Hill, Hugh; Bhardwaj, Anil; Jagadeesh, Gopalan; Reddy, Kalidevapura P. J.; Mason, Nigel J. and Sivaraman, Bhalamurugan, “Shock processing of amino acids leading to complex structures—implications to the origin of life”, Molecules, DOI: 10.3390/molecules25235634, vol. 25, no. 23, Nov. 2020.