Contents

Combinatorial Chemistry & High Throughput Screening, Volume 17 - Number 6

Editorial

Editorial: Chemical Screening: Thinking Big with Big Data

, 17(6): 483 - 484

Gerald Henry Lushington


DOI: 10.2174/138620731706140626145336




Structure-Based Modeling of Dye-Fiber Affinity with SOM-4D-QSAR Paradigm: Application to Set of Anthraquinone Derivatives

, 17(6): 485 - 502

Andrzej Bak, Miroslaw Wyszomirski, Tomasz Magdziarz, Adam Smolinski and Jaroslaw Polanski


DOI: 10.2174/1386207317666140205195252




H3PW12O40-Catalyzed Multicomponent Reaction for Efficient Synthesis of Highly Substituted Piperidines

, 17(6): 503 - 508

Samad Khaksar, Seyed Meysam Baghbanian and Nastaran Barsan


DOI: 10.2174/1386207316666131229132950




Theoretical Studies on Binding and Specificity Mechanisms of Farnesyltransferase (FTase) and Geranylgeranyltransferase Type-I (GGTase-I) Inhibitors by Molecular Modeling

, 17(6): 509 - 519

Shirou Zhou


DOI: 10.2174/1386207317666140120122920




Combinatorial Bead-Based Peptide Libraries Improved for Rapid and Robust Screenings

, 17(6): 520 - 530

Joo-Eun Jee, Yi Li Ang, Junhoe Cha, Mei Wei Ang, Jingjing Ling, Jaehong Lim and Su Seong Lee


DOI: 10.2174/1386207317666140113114403




Investigations on the Antiretroviral Activity of Carbon Nanotubes Using Computational Molecular Approach

, 17(6): 531 - 535

R. Navanietha Krishnaraj, Saravanan Chandran, Parimal Pal and Sheela Berchmans


DOI: 10.2174/1386207317666140116110558




"Old Friends in New Guise": Exploiting Privileged Structures for Scaffold Re-Evolution/Refining

, 17(6): 536 - 553

Yu'ning Song, Wenmin Chen, Dongwei Kang, Qingzhu Zhang, Peng Zhan and Xinyong Liu


DOI: 10.2174/1386207317666140122101631




Computational Evidence for the Reactivation Process of Human Acetylcholinesterase Inhibited by Carbamates

, 17(6): 554 - 564

Karina Silvia Matos, Elaine F. F. da Cunha, Ruben Abagyan and Teodorico C. Ramalho


DOI: 10.2174/1386207316666131217100416




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