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Computational Biology and Chemistry, Volume 71
Volume 71, December 2017
- Akhil Kumar
, Gaurava Srivastava
A physicochemical descriptor based method for effective and rapid screening of dual inhibitors against BACE-1 and GSK-3β as targets for Alzheimer's disease. 1-9 - Muslim Raza, Zahid Khan, Aftab Ahmad, Saleem Raza, Ajab Khan, Imdad Ullah Mohammadzai, Shah Zada:
In silico 3-D structure prediction and molecular docking studies of inosine monophosphate dehydrogenase from Plasmodium falciparum. 10-19 - Mohamed Awad, Ragab M. Fahmy, Kareem A. Mosa
Identification of effective DNA barcodes for Triticum plants through chloroplast genome-wide analysis. 20-31 - Hajar Owji, Ali Hajiebrahimi
Identification and functional prediction of stress responsive AP2/ERF transcription factors in Brassica napus by genome-wide analysis. 32-56 - Joanna Matysiak
QSAR study of pyrazolo[4, 3-e][1, 2, 4]triazine sulfonamides against tumor-associated human carbonic anhydrase isoforms IX and XII. 57-62 - Flavia Maria Sutera
Assessment of in vivo organ-uptake and in silico prediction of CYP mediated metabolism of DA-Phen, a new dopaminergic agent. 63-69 - Hsin-Chieh Tang, Hung-Jin Huang, Cheng-Chun Lee, Calvin Yu-Chian Chen
Network pharmacology-based approach of novel traditional Chinese medicine formula for treatment of acute skin inflammation in silico. 70-81 - Michele Aparecida Salvador
Evaluation of degradation mechanism of chlorhexidine by means of Density Functional Theory calculations. 82-88 - Hassan Aryapour, Maryam Dehdab, Farzin Sohraby, Afshar Bargahi
Prediction of new chromene-based inhibitors of tubulin using structure-based virtual screening and molecular dynamics simulation methods. 89-97 - Zhe Ju, Juhe Sun, Yanjie Li, Li Wang:
Predicting lysine glycation sites using bi-profile bayes feature extraction. 98-103 - Santhosh Kumar Nagarajan
3D-QSAR studies on indole and 7-azoindole derivatives as ROCK-2 inhibitors: An integrative computational approach. 104-116 - Sivakumar Prasanth Kumar
Molecular dynamics-assisted pharmacophore modeling of caspase-3-isatin sulfonamide complex: Recognizing essential intermolecular contacts and features of sulfonamide inhibitor class for caspase-3 binding. 117-128 - Muhammad Arba
Molecular modeling of cationic porphyrin-anthraquinone hybrids as DNA topoisomerase IIβ inhibitors. 129-135 - Lai Jiang, Chaoliang Tang, Jie Rao, Qing Xue, Hao Wu, Dabao Wu, Aijun Zhang, Ling Chen, Zhen Shen, Lei Lei:
Systematic identification of the druggable interactions between human protein kinases and naturally occurring compounds in endometriosis. 136-143 - Anjali Singh
Discovery of potential Zika virus RNA polymerase inhibitors by docking-based virtual screening. 144-151 - Wadood Abdul, Aamir Mehmood
Epitopes based drug design for dengue virus envelope protein: A computational approach. 152-160 - Rabia Musheer Aziz
A novel approach for dimension reduction of microarray. 161-169 - Rua'a A. Al-Aqtash
Ligand-based computational modelling of platelet-derived growth factor beta receptor leading to new angiogenesis inhibitory leads. 170-179 - Tom Kazmirchuk, Kevin Dick
Designing anti-Zika virus peptides derived from predicted human-Zika virus protein-protein interactions. 180-187 - T. K. Shameera Ahamed, K. Muraleedharan:
A ligand-based comparative molecular field analysis (CoMFA) and homology model based molecular docking studies on 3′, 4′-dihydroxyflavones as rat 5-lipoxygenase inhibitors: Design of new inhibitors. 188-200 - Durairaj Sherlin, Sharmila Anishetty:
A pipeline for proteome-scale identification and studies on hormone sensitive lipases in Mycobacterium tuberculosis. 201-206 - S. Kannan, P. Kolandaivel:
Antiviral potential of natural compounds against influenza virus hemagglutinin. 207-218 - Jai Woo Lee
Penalized estimation of sparse concentration matrices based on prior knowledge with applications to placenta elemental data. 219-223 - Rohini Rondla
Selective ATP competitive leads of CDK4: Discovery by 3D-QSAR pharmacophore mapping and molecular docking approach. 224-229
- Tao Ding, Junhua Xu, Mengmeng Sun, Shanshan Zhu, Jie Gao:
Predicting microRNA biological functions based on genes discriminant analysis. 230-235 - Hongyuan Fang, Xianbin Li
Signaling pathway impact analysis by incorporating the importance and specificity of genes (SPIA-IS). 236-244 - Henry Han:
A novel feature selection for RNA-seq analysis. 245-257 - Xuemei Yang, Henry Han:
Factors analysis of protein O-glycosylation site prediction. 258-263 - Guoxian Yu, Yingwen Zhao, Chang Lu
HashGO: hashing gene ontology for protein function prediction. 264-273 - Qiang Zhang
Solving probability reasoning based on DNA strand displacement and probability modules. 274-279
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