Contents

Current Pharmaceutical Design, Volume 22 - Number 23

Editorial

Editorial (Thematic Issue: Molecular Modeling, Molecular Dynamics and Bioinformatics in Pharmaceutical Design)

, 22(23): 3487

Ly Le


DOI: 10.2174/138161282223160614172527




In Silico Approach to Finding New Active Compounds from Histone Deacetylase (HDAC) Family

, 22(23): 3488 - 3497

Arry Yanuar, Azminah, Andika, Linda Erlina and Rezi Riadhi Syahdi


DOI: 10.2174/1381612822666160414142514




Data-driven Approach to Detect and Predict Adverse Drug Reactions

, 22(23): 3498 - 3526

Tu-Bao Ho, Ly Le, Dang Tran Thai and Siriwon Taewijit


DOI: 10.2174/1381612822666160509125047




Modelling DNA Repair Pathways: Recent Advances and Future Directions

, 22(23): 3527 - 3546

Francesco Gentile, Jack A. Tuszynski and Khaled H. Barakat


DOI: 10.2174/1381612822666160420141435




A Perspective on Rational Designs of a Hemagglutinin Based Universal Influenza Vaccine

, 22(23): 3547 - 3554

Thanh D. Van, Nhut Tran, Ly Le and Frank Eisenhaber


DOI: 10.2174/1381612822666160419144352




Miscellaneous Topics in Computer-Aided Drug Design: Synthetic Accessibility and GPU Computing, and Other Topics

, 22(23): 3555 - 3568

Yoshifumi Fukunishi, Tadaaki Mashimo, Kiyotaka Misoo, Yoshinori Wakabayashi, Toshiaki Miyaki, Seiji Ohta, Mayu Nakamura and Kazuyoshi Ikeda


DOI: 10.2174/1381612822666160414142547




Systems Pharmacology: A Unified Framework for Prediction of Drug-Target Interactions

, 22(23): 3569 - 3575

Duc-Hau Le and Ly Le


DOI: 10.2174/1381612822666160418121534




Virtual Screening Techniques and Current Computational Infrastructures

, 22(23): 3576 - 3584

Jason H. Haga, Kohei Ichikawa and Susumu Date


DOI: 10.2174/1381612822666160414142530




The Multifaceted Roles of Molecular Dynamics Simulations in Drug Discovery

, 22(23): 3585 - 3600

Stephen John Fox, Jianguo Li, Yaw Sing Tan, Minh N. Nguyen, Arumay Pal, Zohra Ouaray, Shilpa Yadahalli and Srinivasaraghavan Kannan


DOI: 10.2174/1381612822666160425120507




Insights into the Conformational Ensemble of Human Islet Amyloid Polypeptide from Molecular Simulations

, 22(23): 3601 - 3607

Linh Tran and Tap Ha-Duong


DOI: 10.2174/1381612822666160414142538




Therapeutic Development of Interrelated Metabolic and Neurodegenerative Disorders

, 22(23): 3608 - 3618

Xuan Thi-Anh Nguyen and Ly Le


DOI: 10.2174/1381612822666160420141325




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