LigpKa – a database of pKa values for small molecule ligands designed for the use in structure-based pKa calculations

Detalles Bibliográficos
Autores principales: Czodrowski, P, Søndergaard, CR, Dohm, S, Klebe, G, Nielsen, JE
Formato: Texto
Lenguaje:English
Publicado: BioMed Central 2011
Materias:
Poster Presentation
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3083576/
http://dx.doi.org/10.1186/1758-2946-3-S1-P21
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author Czodrowski, P
Søndergaard, CR
Dohm, S
Klebe, G
Nielsen, JE
author_facet Czodrowski, P
Søndergaard, CR
Dohm, S
Klebe, G
Nielsen, JE
author_sort Czodrowski, P
collection PubMed
description
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id pubmed-3083576
institution National Center for Biotechnology Information
language English
publishDate 2011
publisher BioMed Central
record_format MEDLINE/PubMed
spelling pubmed-30835762011-04-29 LigpKa – a database of pKa values for small molecule ligands designed for the use in structure-based pKa calculations Czodrowski, P Søndergaard, CR Dohm, S Klebe, G Nielsen, JE J Cheminform Poster Presentation BioMed Central 2011-04-19 /pmc/articles/PMC3083576/ http://dx.doi.org/10.1186/1758-2946-3-S1-P21 Text en Copyright ©2011 Czodrowski et al; licensee BioMed Central Ltd. http://creativecommons.org/licenses/by/2.0 This is an open access article distributed under the terms of the Creative Commons Attribution License (http://creativecommons.org/licenses/by/2.0), which permits unrestricted use, distribution, and reproduction in any medium, provided the original work is properly cited.
spellingShingle Poster Presentation
Czodrowski, P
Søndergaard, CR
Dohm, S
Klebe, G
Nielsen, JE
LigpKa – a database of pKa values for small molecule ligands designed for the use in structure-based pKa calculations
title LigpKa – a database of pKa values for small molecule ligands designed for the use in structure-based pKa calculations
title_full LigpKa – a database of pKa values for small molecule ligands designed for the use in structure-based pKa calculations
title_fullStr LigpKa – a database of pKa values for small molecule ligands designed for the use in structure-based pKa calculations
title_full_unstemmed LigpKa – a database of pKa values for small molecule ligands designed for the use in structure-based pKa calculations
title_short LigpKa – a database of pKa values for small molecule ligands designed for the use in structure-based pKa calculations
title_sort ligpka – a database of pka values for small molecule ligands designed for the use in structure-based pka calculations
topic Poster Presentation
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3083576/
http://dx.doi.org/10.1186/1758-2946-3-S1-P21
work_keys_str_mv AT czodrowskip ligpkaadatabaseofpkavaluesforsmallmoleculeligandsdesignedfortheuseinstructurebasedpkacalculations
AT søndergaardcr ligpkaadatabaseofpkavaluesforsmallmoleculeligandsdesignedfortheuseinstructurebasedpkacalculations
AT dohms ligpkaadatabaseofpkavaluesforsmallmoleculeligandsdesignedfortheuseinstructurebasedpkacalculations
AT klebeg ligpkaadatabaseofpkavaluesforsmallmoleculeligandsdesignedfortheuseinstructurebasedpkacalculations
AT nielsenje ligpkaadatabaseofpkavaluesforsmallmoleculeligandsdesignedfortheuseinstructurebasedpkacalculations

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