Search Result "admet"


The Current Use of Mass Spectrometry in Combination with Other Separation Techniques in Drug Discovery Arena

Journal: Medicinal Chemistry
Volume: 12 Issue: 5 Year: 2016 Page: 404-411
Author(s): Piotr Kawczak,Tomasz Baczek

Editorial free to download

Editorial (Thematic Issue: Nanoinformatics to Organic Synthesis, ADMET Profiling, and Application of Nanomaterials in Medicinal Chemistry, Medicine, and Biotechnology)

Journal: Current Topics in Medicinal Chemistry
Volume: 16 Issue: 18 Year: 2016 Page: 1961-1962
Author(s): Santosh K. Srivastava

Research Article

Identification of Novel PPAR?/? Dual Agonists by Virtual Screening of Specs Database

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 19 Issue: 8 Year: 2016 Page: 644-655
Author(s): Jun Zhang, Xin Liu, Shu-Qing Wang, Jing-Wei Fu, Wei-Ren Xu, Xian-Chao Cheng, Run- Ling Wang

Development of Energy-based Pharmacophore Model and Stepwise Virtual Screening of LRRK2 Inhibitors Through Molecular Dynamics and Mechanics

Journal: Letters in Drug Design & Discovery
Volume: 13 Issue: 1 Year: 2016 Page: 24-32
Author(s): Sagar S. Bhayye,Kunal Roy,Achintya Saha

Research Article

Structure-Activity Relationship Studies on Holy Basil (Ocimum sanctum L.) Based Flavonoid Orientin and its Analogue for Cytotoxic Activity in Liver Cancer Cell Line HepG2

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 19 Issue: 8 Year: 2016 Page: 656-666
Author(s): Pooja Sharma, Om Prakash, Aparna Shukla, Chetan Singh Rajpurohit, Prema G. Vasudev, Suaib Luqman, Santosh Kumar Srivastava, Aditya Bhushan Pant, Feroz Khan

Research Article

Molecular Modeling and Virtual Screening Approach to Discover Potential Antileishmanial Inhibitors Against Ornithine Decarboxylase

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 19 Issue: 10 Year: 2016 Page: 813-823
Author(s): Rajan Kumar Pandey,Priyanka Prajapati,Sukriti Goyal,Abhinav Grover,Vijay Kumar Prajapati

Identification of Novel BACE1 Inhibitors by Combination of Pharmacophore Modeling, Structure-Based Design and In Vitro Assay

Journal: Current Computer-Aided Drug Design
Volume: 12 Issue: 1 Year: 2016 Page: 73-82
Author(s): Yuan Ju,Zicheng Li,Yong Deng,Aiping Tong,Liangxue Zhou,Youfu Luo

Coumarin Derivatives as Adjuvants: From In Silico Physicochemical Characterization to In Vitro Evaluation against Gram Positive Bacteria

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 19 Issue: 6 Year: 2016 Page: 489-496
Author(s): Neetu Phougat,Anil Kumar Chhillar,Ashok Kumar Prasad,Nihar N. Senapati,Savita Khatri,Manish Kumar,Smriti Srivastava,Rajesh Dabur

Research Article

Design, Synthesis and Molecular Docking Studies of 2-Aryl/Heteroaryl-Ethyl 6-Chloroquinoline-4-Carboxylates as Potential Antimalarial Agents

Journal: Letters in Drug Design & Discovery
Volume: 13 Issue: 9 Year: 2016 Page: 982-991
Author(s): Thamatakallu O. S. Kumar, Kittappa M. Mahadevan, Pasura S. Sujanganapathy, Manikyanahally N. Kumara

Research Article

Identification of Novel Inhibitors for Disrupting EZH2-EED Interactions Involved in Cancer Epigenetics: An In-Silico Approach

Journal: Current Proteomics
Volume: 13 Issue: 4 Year: 2016 Page: 313-321
Author(s): Utkarsh Raj,Himansu Kumar,Saurabh Gupta,Pritish Kumar Varadwaj

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