1. An insight of novel eutectic mixture between thiazolidine‐2, 4‐dione and zinc chloride: Temperature‐dependent density functional theory approach. (23rd November 2021) Authors: Singh, Madhur Babu; Kumar, Ajay; Jain, Pallavi; Singh, Prashant; Kumari, Kamlesh Journal: Journal of physical organic chemistry Issue: Volume 35:Number 3(2022) Page Start: n/a Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
2. An investigation for the interaction of gamma oryzanol with the Mpro of SARS-CoV-2 to combat COVID-19: DFT, molecular docking, ADME and molecular dynamics simulations. Issue 5 (24th March 2023) Authors: Raman, Anirudh Pratap Singh; Singh, Madhur Babu; Vishvakarma, Vijay Kumar; Jain, Pallavi; Kumar, Ajay; Sachdeva, Shallu; Kumari, Kamlesh; Singh, Prashant Journal: Journal of biomolecular structure & dynamics Issue: Volume 41:Issue 5(2023) Page Start: 1919 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
3. An understanding of coronavirus and exploring the molecular dynamics simulations to find promising candidates against the Mpro of nCoV to combat the COVID-19: A systematic review. Issue 11 (November 2022) Authors: Singh, Madhur Babu; Sharma, Ritika; Kumar, Durgesh; Khanna, Pankaj; Mansi, ; Khanna, Leena; Kumar, Vinod; Kumari, Kamlesh; Gupta, Akanksha; Chaudhary, Preeti; Kaushik, Neha; Choi, Eun Ha; Kaushik, Nagendra Kumar; Singh, Prashant Journal: Journal of infection and public health Issue: Volume 15:Issue 11(2022) Page Start: 1326 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗