Volume 4, supplement issue 1, December 2012
7th German Conference on Chemoinformatics: 25 CIC-Workshop
- Issue editors
91 articles in this issue
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Design of dual ligands using excessive pharmacophore query alignment
Authors (first, second and last of 9)
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ChemProspector and generic structures: advanced mining and searching of chemical content
Authors (first, second and last of 6)
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Ligand based lead generation - considering chemical accessibility in rescaffolding approaches via BROOD
Authors (first, second and last of 4)
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Virtual screening for plant PARP inhibitors – what can be learned from human PARP inhibitors?
Authors (first, second and last of 4)
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Structured chemical class definitions and automated matching for chemical ontology evolution
Authors (first, second and last of 5)
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Assessment of a probabilistic framework for combining structure- and ligand-based virtual screening
Authors (first, second and last of 4)
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Applying the unified pH scale: absolute acidities in the gas phase and anchor points for eleven representative liquid media
Authors (first, second and last of 4)
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Tabu search based global optimization algorithms for problems in computational chemistry
Authors (first, second and last of 4)
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A flexible-hydrogen interaction model for protein-ligand docking
Authors (first, second and last of 4)
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Asymmetric transfer hydrogenation of imines and ketones using chiral Ru(II)Cl(η6-p-cymene)[(S,S)-N-TsDPEN] catalyst: a computational study
Authors (first, second and last of 4)
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MoSGrid: efficient data management and a standardized data exchange format for molecular simulations in a grid environment
Authors (first, second and last of 18)
