401. Discovery of new Gyrase β inhibitors via structure based modeling. (June 2018) Authors: Al-Nadaf, Afaf H.; Salah, Sajeda A.; Taha, Mutasem O. Journal: Computational biology and chemistry Issue: Volume 74(2018) Page Start: 263 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
402. Discovery of new inhibitor for the protein arginine deiminase type 4 (PAD4) by rational design of α-enolase-derived peptides. (June 2021) Authors: Ahmad Nadzirin, Izzuddin; Chor, Adam Leow Thean; Salleh, Abu Bakar; Rahman, Mohd Basyaruddin Abdul; Tejo, Bimo A. Journal: Computational biology and chemistry Issue: Volume 92(2021) Page Start: Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
403. Discovery of novel drug candidates for inhibition of soluble epoxide hydrolase of arachidonic acid cascade pathway implicated in atherosclerosis. (June 2018) Authors: Gurung, Arun Bahadur; Mayengbam, Bishwarjit; Bhattacharjee, Atanu Journal: Computational biology and chemistry Issue: Volume 74(2018) Page Start: 1 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
404. Discovery of novel indoleamine 2, 3-dioxygenase 1 (IDO1) inhibitors by virtual screening. (February 2019) Authors: Zhou, Yeheng; Peng, Jiale; Li, Penghua; Du, Haibo; Li, Yaping; Li, Yingying; Zhang, Li; Sun, Wei; Liu, Xingyong; Zuo, Zhili Journal: Computational biology and chemistry Issue: Volume 78(2019) Page Start: 306 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
405. Discovery of potent IRAK-4 inhibitors as potential anti-inflammatory and anticancer agents using structure-based exploration of IRAK-4 pharmacophoric space coupled with QSAR analyses. (April 2019) Authors: Khanfar, Mohammad A.; Alqtaishat, Saja Journal: Computational biology and chemistry Issue: Volume 79(2019) Page Start: 147 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
406. Discovery of potential inhibitor against human acetylcholinesterase: a molecular docking and molecular dynamics investigation. (June 2017) Authors: Singh, Surya Pratap; Gupta, Dwijendra Journal: Computational biology and chemistry Issue: Volume 68(2017) Page Start: 224 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
407. Discovery of potential inhibitors targeting the kinase domain of polynucleotide kinase/phosphatase (PNKP): Homology modeling, virtual screening based on multiple conformations, and molecular dynamics simulation. (October 2021) Authors: Zhu, Jingyu; Zhang, Haoer; Jia, Lei; Ma, Lijun; Xu, Lei; Chen, Yun; Cai, Yanfei; Li, Huazhong; Huang, Gang; Jin, Jian Journal: Computational biology and chemistry Issue: Volume 94(2021) Page Start: Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
408. Discovery of potential Zika virus RNA polymerase inhibitors by docking-based virtual screening. (December 2017) Authors: Singh, Anjali; Jana, Nandan Kumar Journal: Computational biology and chemistry Issue: Volume 71(2017) Page Start: 144 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
409. Discovery of potentially biased agonists of mu-opioid receptor (MOR) through molecular docking, pharmacophore modeling, and MD simulation. (February 2021) Authors: Jiang, Xuan; Li, Shuxiang; Zhang, Hongbin; Wang, Liang-Liang Journal: Computational biology and chemistry Issue: Volume 90(2021) Page Start: Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
410. Discovery of small-molecule PD-1/PD-L1 antagonists through combined virtual screening and experimental validation. (February 2023) Authors: DiFrancesco, Michelle; Hofer, Jeremy; Aradhya, Abhay; Rufinus, Jeffrey; Stoddart, John; Finocchiaro, Stephen; Mani, Jabari; Tevis, Sean; Visconti, Michael; Walawender, Griffin; DiFlumeri, Juliette; Fattakhova, Elena; Patil, Sachin P. Journal: Computational biology and chemistry Issue: Volume 102(2023) Page Start: Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗