Search Result "in silico screening"


In silico Screening for Identification of Novel Anti-malarial Inhibitors by Molecular Docking, Pharmacophore Modeling and Virtual Screening

Journal: Medicinal Chemistry
Volume: 11 Issue: 7 Year: 2015 Page: 687-700
Author(s): Sidra Batool,Zeshan Aslam Khan,Warda Kamal,Gohar Mushtaq,Mohammad Amjad Kamal

In Silico Designing and Screening of Antagonists against Cancer Drug Target XIAP

Journal: Current Cancer Drug Targets
Volume: 15 Issue: 9 Year: 2015 Page: 836-846
Author(s): Rahul Kumar,Jagat Singh Chauhan,Gajendra Pal Singh Raghava

In Silico Identification of Irreversible Cathepsin B Inhibitors as Anti- Cancer Agents: Virtual Screening, Covalent Docking Analysis and Molecular Dynamics Simulations

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 18 Issue: 4 Year: 2015 Page: 399-410
Author(s): Mbatha Sbongile, Mahmoud E.S. Soliman

Virtual Screening for Novel Staphylococcus Aureus NorA Efflux Pump Inhibitors From Natural Products

Journal: Medicinal Chemistry
Volume: 11 Issue: 2 Year: 2015 Page: 135-155
Author(s): Khac-Minh Thai,Trieu-Du Ngo,Thien-Vy Phan,Thanh-Dao Tran,Ngoc-Vinh Nguyen,Thien-Hai Nguyen,Minh-Tri Le

ChemScreener: A Distributed Computing Tool for Scaffold based Virtual Screening

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 18 Issue: 6 Year: 2015 Page: 544-561
Author(s): Muthukumarasamy Karthikeyan,Deepak Pandit,Renu Vyas

Discovery of Anti-Malarial Agents Through Application of In Silico Studies

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 18 Issue: 2 Year: 2015 Page: 151-187
Author(s): Mahesh A. Barmade,Prashant R. Murumkar,Mayank Kumar Sharma,Kaushik P. Shingala,Rajani R. Giridhar,Mange Ram Yadav

LiSIs: An Online Scientific Workflow System for Virtual Screening

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 18 Issue: 3 Year: 2015 Page: 281-295
Author(s): Christos C. Kannas,Ioanna Kalvari,George Lambrinidis,Christiana M. Neophytou,Christiana G. Savva,Ioannis Kirmitzoglou,Zinonas Antoniou,Kleo G. Achilleos,David Scherf,Chara A. Pitta,Christos A. Nicolaou,Emanuel Mikros,Vasilis J. Promponas,Clarissa Gerhauser,Rajendra G. Mehta,Andreas I. Constantinou,Constantinos S. Pattichis

Purification, Characterization and In-silico Analysis of Nitrilase from Gordonia terrae

Journal: Protein & Peptide Letters
Volume: 22 Issue: 1 Year: 2015 Page: 52-62
Author(s): Vijay Kumar,Amit Seth,Vijaya Kumari,Virender Kumar,Tek C. Bhalla

Role of Chemical Reactivity and Transition State Modeling for Virtual Screening

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 18 Issue: 7 Year: 2015 Page: 638-657
Author(s): Muthukumarasamy Karthikeyan,Renu Vyas,Sanjeev S. Tambe,Deepthi Radhamohan,Bhaskar D. Kulkarni

Discovery of GPCR Ligands by Molecular Docking Screening: Novel Opportunities Provided by Crystal Structures

Journal: Current Topics in Medicinal Chemistry
Volume: 15 Issue: 24 Year: 2015 Page: 2484-2503
Author(s): David Rodríguez,Anirudh Ranganathan,Jens Carlsson

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