Literature DB >> 17366512

Chemical space travel.

Ruud van Deursen1, Jean-Louis Reymond.   

Abstract

Mesh：

Year:  2007        PMID： 17366512     DOI： 10.1002/cmdc.200700021

Source DB:  PubMed          Journal:  ChemMedChem        ISSN： 1860-7179            Impact factor:   3.466


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  11 in total

1.  Estimation of the size of drug-like chemical space based on GDB-17 data.

Authors:  P G Polishchuk; T I Madzhidov; A Varnek
Journal:  J Comput Aided Mol Des       Date:  2013-08-21       Impact factor: 3.686

2.  The octet rule in chemical space: generating virtual molecules.

Authors:  Rafel Israels; Astrid Maaß; Jan Hamaekers
Journal:  Mol Divers       Date:  2017-08-03       Impact factor: 2.943

3.  Stochastic voyages into uncharted chemical space produce a representative library of all possible drug-like compounds.

Authors:  Aaron M Virshup; Julia Contreras-García; Peter Wipf; Weitao Yang; David N Beratan
Journal:  J Am Chem Soc       Date:  2013-05-02       Impact factor: 15.419

4.  Synthesis and chemical diversity analysis of bicyclo[3.3.1]non-3-en-2-ones.

Authors:  Jared T Hammill; Julia Contreras-García; Aaron M Virshup; David Beratan; Weitao Yang; Peter Wipf
Journal:  Tetrahedron       Date:  2010-03-31       Impact factor: 2.457

5.  Molpher: a software framework for systematic chemical space exploration.

Authors:  David Hoksza; Petr Skoda; Milan Voršilák; Daniel Svozil
Journal:  J Cheminform       Date:  2014-03-21       Impact factor: 5.514

6.  Use of the University of Minnesota Biocatalysis/Biodegradation Database for study of microbial degradation.

Authors:  Lynda Bm Ellis; Lawrence P Wackett
Journal:  Microb Inform Exp       Date:  2012-01-04

7.  Lost in chemical space? Maps to support organometallic catalysis.

Authors:  Natalie Fey
Journal:  Chem Cent J       Date:  2015-06-18       Impact factor: 4.215

8.  Strategy to discover diverse optimal molecules in the small molecule universe.

Authors:  Chetan Rupakheti; Aaron Virshup; Weitao Yang; David N Beratan
Journal:  J Chem Inf Model       Date:  2015-02-19       Impact factor: 4.956

9.  Molecular structures enumeration and virtual screening in the chemical space with RetroPath2.0.

Authors:  Mathilde Koch; Thomas Duigou; Pablo Carbonell; Jean-Loup Faulon
Journal:  J Cheminform       Date:  2017-12-19       Impact factor: 5.514

10.  Automatic Chemical Design Using a Data-Driven Continuous Representation of Molecules.

Authors:  Rafael Gómez-Bombarelli; Jennifer N Wei; David Duvenaud; José Miguel Hernández-Lobato; Benjamín Sánchez-Lengeling; Dennis Sheberla; Jorge Aguilera-Iparraguirre; Timothy D Hirzel; Ryan P Adams; Alán Aspuru-Guzik
Journal:  ACS Cent Sci       Date:  2018-01-12       Impact factor: 14.553
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