Role of In Silico Stereoelectronic Properties and Pharmacophores in Aid of Discovery of Novel Antimalarials, Antileishmanials, and Insect Repellents (English)
- New search for: K. Bhattacharjee, Apurba
- New search for: K. Bhattacharjee, Apurba
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Title:Role of In Silico Stereoelectronic Properties and Pharmacophores in Aid of Discovery of Novel Antimalarials, Antileishmanials, and Insect Repellents
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Contributors:K. Bhattacharjee, Apurba ( author )
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Published in:
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Publisher:
- New search for: Bentham Science Publishers Ltd.
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Publication date:2015
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ISBN:
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Type of media:Article/Chapter (Book)
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Type of material:Electronic Resource
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Language:English
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Keywords:insect repellents , compound database , stereo-electronic properties , CATALYST methodology , malaria , virtual screening , drug design , molecular electrostatic potentials (MEPs) , quantum chemical (QM) calculations , drug discovery , novel compounds. , parasites , In Silico pharmacophore models , leishmaniasis , arthropods
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Source:
Table of contents eBook
The tables of contents are generated automatically and are based on the data records of the individual contributions available in the index of the TIB portal. The display of the Tables of Contents may therefore be incomplete.
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ContributorsC. Basak, Subhash / Restrepo, Guillermo / L. Villaveces, José et al. | 2015
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AcknowledgementsC. Basak, Subhash / Restrepo, Guillermo / L. Villaveces, José et al. | 2015
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Mathematical Structural Descriptors of Molecules and Biomolecules: Background and ApplicationsC. Basak, Subhash et al. | 2015
- 4
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Ordering Thinking in ChemistryRestrepo, Guillermo et al. | 2015
- 5
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On the Concept for Overall Topological Representation of Molecular StructureBonchev, Danail et al. | 2015
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The Four Connectivity Matrices, Their Indices, Polynomials and SpectraLučić, Bono / Sović, Ivan / Trinajstić, Nenad et al. | 2015
- 7
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The Use of Weighted 2D Fingerprints in Similarity- Based Virtual ScreeningM. Arif, Shereena / D. Holliday, John / Willett, Peter et al. | 2015
- 8
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MOLGEN 5.0, A Molecular Structure GeneratorGugisch, Ralf / Kerber, Adalbert / Kohnert, Axel / Laue, Reinhard / Meringer, Markus / Rücker, Christoph / Wassermann, Alfred et al. | 2015
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On Comparability Graphs: Theory and ApplicationsDehmer, Matthias / Sivakumar, Lavanya et al. | 2015
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Basic Concepts and Applications of Molecular Topology to Drug DesignGálvez, Jorge / Gálvez-Llompart, María / García-Domenech, Ramón et al. | 2015
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Conceptual Density Functional Theory of Chemical ReactivityK. Chattaraj, Pratim / R. Roy, Debesh et al. | 2015
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Mathematical (Structural) Descriptors in QSAR: Applications in Drug Design and Environmental ToxicologyVračko, Marjan et al. | 2015
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“Current Landscape of Hierarchical QSAR Modeling and its Applications: Some Comments on the Importance of Mathematical Descriptors as well as Rigorous Statistical Methods of Model Building and Validation”C. Basak, Subhash / Majumdar, Subhabrata et al. | 2015
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Recent Advances in the Assessment of Druglikeness Using 2D-Structural DescriptorsRajesh, Hariharan / Rajagopalan, Lakshminarasimhan / N. Viswanadhan, Vellarkad et al. | 2015
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Role of In Silico Stereoelectronic Properties and Pharmacophores in Aid of Discovery of Novel Antimalarials, Antileishmanials, and Insect RepellentsK. Bhattacharjee, Apurba et al. | 2015
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Molecular TaxonomyHefferlin, Ray et al. | 2015
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Subject IndexC. Basak, Subhash / Restrepo, Guillermo / L. Villaveces, José et al. | 2015