(Q56977927)

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Prediction of enantiomeric selectivity in chromatography

scientific article published on 01 March 2002

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Europe PubMed Central

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https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:11885960%20AND%20SRC:MED&resulttype=core&format=json

8 December 2019

Prediction of enantiomeric selectivity in chromatography. Application of conformation-dependent and conformation-independent descriptors of molecular chirality (English)

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8 December 2019

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João Aires de Sousa

1

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8 December 2019

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Johann Gasteiger

2

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8 December 2019

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1 March 2002

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8 December 2019

Journal of Molecular Graphics & Modelling

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8 December 2019

20

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8 December 2019

5

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8 December 2019

373-388

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8 December 2019

Deriving a quantitative chirality measure from molecular similarity indices

1 reference

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Prediction of properties of chiral compounds by molecular topology

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Novel chirality descriptors derived from molecular topology

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New 4-point pharmacophore method for molecular similarity and diversity applications: overview of the method and applications, including a novel approach to the design of combinatorial libraries containing privileged substructures

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New Description of Molecular Chirality and Its Application to the Prediction of the Preferred Enantiomer in Stereoselective Reactions

1 reference

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7 January 2021

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Atomistic modeling of enantioselective binding

1 reference

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Prediction of Chiral Chromatographic Separations Using Combined Multivariate Regression and Neural Networks

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High-performance liquid chromatographic separation of enantiomers of unusual amino acids on a teicoplanin chiral stationary phase

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Deriving the 3D structure of organic molecules from their infrared spectra

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Iterative partial equalization of orbital electronegativity—a rapid access to atomic charges

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Automatic generation of 3D-atomic coordinates for organic molecules

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Comparison of Automatic Three-Dimensional Model Builders Using 639 X-ray Structures

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Identifiers

10.1016/S1093-3263(01)00136-X

1 reference

Europe PubMed Central

PubMed publication ID

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:11885960%20AND%20SRC:MED&resulttype=core&format=json

8 December 2019

PubMed publication ID

1 reference

Europe PubMed Central

PubMed publication ID

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:11885960%20AND%20SRC:MED&resulttype=core&format=json

8 December 2019

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