1. 1, 3-Oxazole derivatives as potential anticancer agents: Computer modeling and experimental study. (December 2016) Authors: Semenyuta, Ivan; Kovalishyn, Vasyl; Tanchuk, Vsevolod; Pilyo, Stepan; Zyabrev, Vladimir; Blagodatnyy, Volodymyr; Trokhimenko, Olena; Brovarets, Volodymyr; Metelytsia, Larysa Journal: Computational biology and chemistry Issue: Volume 65(2016) Page Start: 8 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
2. 1, 3-Oxazole derivatives of cytisine as potential inhibitors of glutathione reductase of Candida spp.: QSAR modeling, docking analysis and experimental study of new anti-Candida agents. (February 2021) Authors: Metelytsia, Larysa O.; Trush, Maria M.; Kovalishyn, Vasyl V.; Hodyna, Diana M.; Kachaeva, Maryna V.; Brovarets, Volodymyr S.; Pilyo, Stepan G.; Sukhoveev, Volodymyr V.; Tsyhankov, Serhii A.; Blagodatnyi, Volodymyr M.; Semenyuta, Ivan V. 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) ↗
3. 2, 4-Ditellurouracil and its 5-fluoro derivative: Theoretical investigations of structural, energetics and ADME parameters. (June 2017) Authors: Alswaidan, Ibrahim A.; Sooknah, Kritish; Rhyman, Lydia; Parlak, Cemal; Ndinteh, Derek T.; Elzagheid, Mohamed I.; Ramasami, Ponnadurai Journal: Computational biology and chemistry Issue: Volume 68(2017) Page Start: 56 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
4. 2-Furoic piperazide derivatives as promising drug candidates of type 2 diabetes and Alzheimer's diseases: In vitro and in silico studies. (December 2018) Authors: Abbasi, Muhammad Athar; Hassan, Mubashir; ur-Rehman, Aziz; Siddiqui, Sabahat Zahra; Hussain, Ghulam; Shah, Syed Adnan Ali; Ashraf, Muhammad; Shahid, Muhammad; Seo, Sung Yum Journal: Computational biology and chemistry Issue: Volume 77(2018) Page Start: 72 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
5. 2/3D-QSAR, molecular docking and MD simulation studies of FtsZ protein targeting benzimidazoles derivatives. (February 2019) Authors: Ahamad, Shahzaib; Islam, Asimul; Ahmad, Faizan; Dwivedi, Neeraj; Hassan, Md. Imtaiyaz Journal: Computational biology and chemistry Issue: Volume 78(2019) Page Start: 398 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
6. 279Val→Phe Polymorphism of lipoprotein-associated phospholipase A2 resulted in changes of folding kinetics and recognition to substrate. (December 2015) Authors: Masbuchin, Ainun Nizar; Rohman, Mohammad Saifur; Putri, Jayarani Fatimah; Cahyaningtyas, Miryanti; Widodo, Journal: Computational biology and chemistry Issue: Volume 59:Part A(2015) Page Start: 199 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
7. 3D QSAR Pharmacophore Based Virtual Screening for Identification of Potential Inhibitors for CDC25B. (April 2018) Authors: Ma, Ying; Li, Hong-Lian; Chen, Xiu-Bo; Jin, Wen-Yan; Zhou, Hui; Ma, Ying; Wang, Run-Ling Journal: Computational biology and chemistry Issue: Volume 73(2018) Page Start: 1 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
8. 3D QSAR studies, molecular docking and ADMET evaluation, using thiazolidine derivatives as template to obtain new inhibitors of PIM1 kinase. (June 2018) Authors: Aouidate, Adnane; Ghaleb, Adib; Ghamali, Mounir; Ousaa, Abdellah; Choukrad, M'barek; Sbai, Abdelouahid; Bouachrine, Mohammed; Lakhlifi, Tahar Journal: Computational biology and chemistry Issue: Volume 74(2018) Page Start: 201 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
9. 3D-QSAR studies of some reversible Acetyl cholinesterase inhibitors based on CoMFA and ligand protein interaction fingerprints using PC-LS-SVM and PLS-LS-SVM. (August 2017) Authors: Ghafouri, Hamidreza; Ranjbar, Mohsen; Sakhteman, Amirhossein Journal: Computational biology and chemistry Issue: Volume 69(2017) Page Start: 19 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
10. 3D-QSAR studies on indole and 7-azoindole derivatives as ROCK-2 inhibitors: An integrative computational approach. (December 2017) Authors: Nagarajan, Santhosh Kumar; Babu, Sathya; Sohn, Honglae; Devaraju, Panneer; Madhavan, Thirumurthy Journal: Computational biology and chemistry Issue: Volume 71(2017) Page Start: 104 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗