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The top documents tagged [multiple conformations]
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multiple conformations
ChemAxon in 3D Gábor Imre, Adrián Kalászi and Miklós Vargyas Solutions for Cheminformatics.
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PHAR201 Lecture 2 20121 Principles of DNA and RNA Structure PHAR 201/Bioinformatics I Philip E. Bourne Department of Pharmacology, UCSD Prerequisite Reading:
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Biochem introduction to genetics(june.15.2010)
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The computational method
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Improved PKa Calculations
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Protein Structural Prediction. Protein Structure is Hierarchical.
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By: Z. S. Rezaei. Structural comparison Structural alignment spectrum of structural alignment methods The properties of output Types of comparison.
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Problems and Opportunities for Machine Learning in Drug Discovery (Can you find lessons for Systems Biology?) George S. Cowan, Ph.D. Computer Aided Drug.
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ChemAxon in 3D
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In silico discovery of inhibitors using structure-based approaches Jasmita Gill Structural and Computational Biology Group, ICGEB, New Delhi Nov 2005.
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Receptor-based virtual screening Lab version 2. Virtual screening Goal: identify ligands that tightly bind to a protein Requirements: a computer database.
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Electronic and vibronic spectroscopy of crown ether water complexes: benzo-15-crown-5 (B15C) and 4’-aminobenzo- 15-crown (ABC) V. Alvin Shubert and Timothy.
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