화학공학소재연구정보센터(CHERIC) | 연구정보 | 문헌DB

검색결과 : 188건

No.	Article
1	Highland games: A benchmarking exercise in predicting biophysical and drug properties of monoclonal antibodies from amino acid sequences Coffman J, Marques B, Orozco R, Aswath M, Mohammad H, Zimmermann E, Khouri J, Griesbach J, Izadi S, Williams A, Sankar K, Walters B, Lin J, Hepbildikler S, Schiel J, Welsh J, Ferreira G, Delmar J, Mody N, Afdahl C, Cui TT, Khalaf R, Hanke A, Pampel L, Parimal S, Hong X, Patil U, Pollard J, Insaidoo F, Robinson J, Chandra D, Blanco M, Panchal J, Soundararajan S, Roush D, Tugcu N, Cramer S, Haynes C, Willson RC Biotechnology and Bioengineering, 117(7), 2100, 2020
2	Quantum chemical descriptors based QSAR modeling of neodymium carboxylate catalysts for coordination polymerization of isoprene Xiang SG, Wang JY Chinese Journal of Chemical Engineering, 28(7), 1805, 2020
3	Bis benzothiophene Schiff bases: synthesis and in silico-guided biological activity studies Unver Y, Unluer D, Direkel S, Durdagi S Turkish Journal of Chemistry, 44(4), 1164, 2020
4	Combined ligand and structure-based virtual screening approaches for identification of novel AChE inhibitors Sahin K, Durdagi S Turkish Journal of Chemistry, 44(3), 574, 2020
5	Computational simulation and statistical analysis on the relationship between corrosion inhibition efficiency and molecular structure of some hydrazine derivatives in phosphoric acid on mild steel surface Belghiti ME, Echihi S, Dafali A, Karzazi Y, Bakasse M, Elalaoui-Elabdallaoui H, Olasunkanmi LO, Ebenso EE, Tabyaoui M Applied Surface Science, 491, 707, 2019
6	Synergy effect of E-peroxone process in the degradation of structurally diverse pharmaceuticals: A QSAR analysis Li X, Wang B, Wang YJ, Li K, Yu G Chemical Engineering Journal, 360, 1111, 2019
7	Designing modified polybrominated diphenyl ether BDE-47, BDE-99, BDE-100, BDE-183, and BDE-209 molecules with decreased estrogenic activities using 3D-QSAR, pharmacophore models coupled with resolution V of the 2(10-3) fractional factorial design and molecular docking Chu ZH, Li Y Journal of Hazardous Materials, 364, 151, 2019
8	Environmentally friendly polychlorinated naphthalenes (PCNs) derivatives designed using 3D-QSAR and screened using molecular docking, density functional theory and health-based risk assessment Gu WW, Zhao YY, Li Q, Li Y Journal of Hazardous Materials, 363, 316, 2019
9	Ecotoxicological QSAR modeling of endocrine disruptor chemicals Khan K, Roy K, Benfenati E Journal of Hazardous Materials, 369, 707, 2019
10	A new tool to rationally design highly efficient organic sensitizers for dye-sensitized solar cells: A three-dimensional quantitative structure-activity relationship (3D-QSAR) perspective Yan GC, Yang XL, Albijanic B, Zhou Y, Zhou Y, Zhu XN Solar Energy, 184, 187, 2019