Cargando…

Deterministic clustering of the available chemical space

Detalles Bibliográficos
Autores principales:	Thiel, Philipp, Peltason, Lisa, Ottmann, Christian, Kohlbacher, Oliver
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	BioMed Central 2013
Materias:	Poster Presentation
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3606189/ http://dx.doi.org/10.1186/1758-2946-5-S1-P53

Ejemplares similares

SAR Analyzer: a tool for interactive SAR data visualization and navigation
por: Peltason, Lisa, et al.
Publicado: (2012)

Systematic extraction of structure-activity relationship information from biological screening data
por: Wawer, Mathias, et al.
Publicado: (2010)

Deterministic neural networks as sources of uncorrelated noise for probabilistic computations
por: Jordan, Jakob, et al.
Publicado: (2015)

Putting the available chemical space to the fingertips of our scientists
por: Degen, Jörg, et al.
Publicado: (2012)

Local structure supports learning of deterministic behavior in recurrent neural networks
por: Binas, Jonathan, et al.
Publicado: (2015)

Software for spatial analysis and visualisation of cluster randomised trials - a review of available tools
por: Jarvis, Christopher, et al.
Publicado: (2015)

Relating GPCRs pharmacological space based on ligands chemical similarities
por: Koutsoukas, Alexios, et al.
Publicado: (2013)

Using graph-based consensus clustering for combining K-means clustering of heterogeneous chemical structures
por: Saeed, Faisal, et al.
Publicado: (2013)

Key features of neural variability emerge from self-organized sequence learning in a deterministic neural network
por: Hartmann, Christoph, et al.
Publicado: (2015)

Towards understanding the chemical environment effect on gold-containing clusters
por: Mollenhauer, Doreen, et al.
Publicado: (2014)

Application of spectrophores™ to map vendor chemical space using self-organising maps
por: Thijs, G, et al.
Publicado: (2011)

A large scale classification of molecular fingerprints for the chemical space representation and SAR analysis
por: López-Vallejo, Fabian, et al.
Publicado: (2012)

ChemicalToolBoX and its application on the study of the drug like and purchasable space
por: Lucas, Xavier, et al.
Publicado: (2014)

KnowledgeSpace - a publicly available virtual chemistry space
por: Detering, Carsten, et al.
Publicado: (2010)

Rescoring of docking poses using force field-based methods
por: Fischer, Nina M, et al.
Publicado: (2010)

The fate of orally available antimicrobials
por: Catry, B, et al.
Publicado: (2011)

Availability and affordability of medicines for children
por: Kazaryan, Irina, et al.
Publicado: (2015)

Benchmarking of commercially available CHO cell culture media for antibody production
por: Reinhart, David, et al.
Publicado: (2013)

A framework and workflow system for virtual screening and molecular docking
por: Schumann, M, et al.
Publicado: (2011)

Clustering noisy data with deterministic annealing
por: Ohlsson, M
Publicado: (1993)

Structure of space and the submicroscopic deterministic concept of physics
por: Krasnoholovets, Volodymyr
Publicado: (2016)

Mortality as a measure of lack of ICU availability
por: Levin, P, et al.
Publicado: (2006)

Improving visualization and analysis of relationships between neuronal model parameters in discrete parameter spaces
por: McKee, Lisa, et al.
Publicado: (2011)

Searching for tunnels of proteins – comparison of approaches and available software tools
por: Jaiswal, Deepti, et al.
Publicado: (2012)

Evaluation of available data on physiological track and trigger warning systems
por: Gao, H, et al.
Publicado: (2006)

Availability of appropriate airway monitoring at UK in-hospital cardiac arrest
por: Turle, S, et al.
Publicado: (2015)

The OpenWorm Project: currently available resources and future plans
por: Gleeson, Padraig, et al.
Publicado: (2015)

Introducing fuzziness into maximum common substructures for meaningful cluster characterisation
por: Herhaus, Christian
Publicado: (2014)

The structure of human olfactory space
por: Koulakov, Alexei, et al.
Publicado: (2013)

Expanding and understanding metabolite space
por: Peironcely, Julio E, et al.
Publicado: (2010)

Searching substructures in fragment spaces
por: Ehrlich, H-C, et al.
Publicado: (2011)

Further adventures in shape space
por: Hawkins, Paul, et al.
Publicado: (2008)

Clustering in surgical trials – database of intra-cluster correlations
por: Cook, Jonathan A, et al.
Publicado: (2011)

Sample size in cluster randomised trials with unequal clusters
por: Holloway, Ivana, et al.
Publicado: (2011)

Altering substrate availability profoundly affects left ventricular function in the normal heart
por: Lewis, Andrew, et al.
Publicado: (2016)

The role of cluster size and intra-cluster correlations when adjusting for covariates in the analysis of cluster randomised trials
por: Wright, Neil
Publicado: (2015)

Comparing manual and automated extraction of chemical entities from documents
por: Tyrchan, Christian, et al.
Publicado: (2010)

What is the best available evidence for treatment of first metatarsophalangeal joint osteoarthritis?
por: Zammit, Gerard V, et al.
Publicado: (2011)

Flying non-LTR retrotransposons: DNA transposons as freely available ''wings''?
por: Novikova, Olga, et al.
Publicado: (2009)

Use of capnography and the availability of airway equipment on UK intensive care units
por: Georgiou, A, et al.
Publicado: (2010)

Cannot write session to /tmp/vufind_sessions/sess_h5il7uqi5m6cjr5mld2db928on