(Q39156659)

9 September 2017

title

Design of a general-purpose European compound screening library for EU-OPENSCREEN. (English)

1 reference

9 September 2017

Bernd Rupp

3

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Jordi Quintana

Jordi Quintana

18

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Fredrik Almqvist

Fredrik Almqvist

9

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Jordi Mestres

Jordi Mestres

14

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Gilles Marcou

Gilles Marcou

15

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Anna-Lena Gustavsson

Anna-Lena Gustavsson

12

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Didier Rognan

7

Didier Rognan

1 reference

9 September 2017

1

Dragos Horvath

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9 September 2017

10

Mikael Elofsson

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9 September 2017

13

Nikita Remez

1 reference

9 September 2017

Michael Lisurek

2

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9 September 2017

Ronald Kühne

4

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9 September 2017

Edgar Specker

5

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9 September 2017

Jens von Kries

6

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9 September 2017

C David Andersson

8

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9 September 2017

Per-Anders Enqvist

11

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9 September 2017

Alexander Varnek

16

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9 September 2017

Marcel Hibert

17

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9 September 2017

Ronald Frank

19

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9 September 2017

publication date

15 July 2014

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9 September 2017

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9 September 2017

volume

9

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9 September 2017

issue

10

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9 September 2017

page(s)

2309-2326

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Prediction of aqueous solubility of a diverse set of compounds using quantitative structure-property relationships

9 September 2017

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Scientific workflow systems: Pipeline Pilot and KNIME

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Design of chemical libraries with potentially bioactive molecules applying a maximum common substructure concept

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Using extended-connectivity fingerprints with Laplacian-modified Bayesian analysis in high-throughput screening follow-up

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Extended-connectivity fingerprints

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Optimization and visualization of molecular diversity of combinatorial libraries

21 January 2018

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Principal component analysis

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21 January 2018

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21 January 2018

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Linking pharmacology to clinical reports: cyclobenzaprine and its possible association with serotonin syndrome

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Identification of pim kinases as novel targets for PJ34 with confounding effects in PARP biology.

21 January 2018

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Identification of small molecule inhibitors of amyloid β-induced neuronal apoptosis acting through the imidazoline I(2) receptor.

21 January 2018

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Fuzzy tricentric pharmacophore fingerprints. 1. Topological fuzzy pharmacophore triplets and adapted molecular similarity scoring schemes.

21 January 2018

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Fuzzy tricentric pharmacophore fingerprints. 2. Application of topological fuzzy pharmacophore triplets in quantitative structure-activity relationships.

21 January 2018

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Chemical Similarity Searching

21 January 2018

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Using self-organizing maps to accelerate similarity search

21 January 2018

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ISIDA Property-Labelled Fragment Descriptors.

21 January 2018

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Experimental and computational approaches to estimate solubility and permeability in drug discovery and development settings

21 January 2018

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Pursuing the leadlikeness concept in pharmaceutical research.

21 January 2018

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Rational methods for the selection of diverse screening compounds

21 January 2018

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Cross-pharmacology analysis of G protein-coupled receptors

21 January 2018

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Scaffold hopping by "fuzzy" pharmacophores and its application to RNA targets

21 January 2018

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Pharmacophore-based virtual screening

21 January 2018

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International Union of Basic and Clinical Pharmacology. LXXIX. Cannabinoid receptors and their ligands: beyond CB₁ and CB₂

21 January 2018

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On Outliers and Activity Cliffs - Why QSAR Often Disappoints

21 January 2018

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French/European academic compound library initiative

21 January 2018

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7 January 2021

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7 January 2021

Ligand-based approaches to in silico pharmacology

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7 January 2021

Drug- and lead-likeness, target class, and molecular diversity analysis of 7.9 million commercially available organic compounds provided by 29 suppliers

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https://api.crossref.org/works/10.1002%2FCMDC.201402126

7 January 2021

Identifiers

DOI

10.1002/CMDC.201402126

1 reference

9 September 2017

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