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Scientific workflow systems: Pipeline Pilot and KNIME

Journal of computer-aided molecular design, 2012-07, Vol.26 (7), p.801-804

Warr, Wendy A.

2012

Volltextzugriff (PDF)

A Short Review of Chemical Reaction Database Systems, Computer-Aided Synthesis Design, Reaction Prediction and Synthetic Feasibility

Molecular informatics, 2014-06, Vol.33 (6-7), p.469-476

Warr, Wendy A.

2014

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Exploration of Ultralarge Compound Collections for Drug Discovery

Journal of chemical information and modeling, 2022-05, Vol.62 (9), p.2021-2034

2022

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ChEMBL. An interview with John Overington, team leader, chemogenomics at the European Bioinformatics Institute Outstation of the European Molecular Biology Laboratory (EMBL-EBI)

Journal of computer-aided molecular design, 2009-04, Vol.23 (4), p.195-198

Warr, Wendy A.

2009

Volltextzugriff (PDF)

A CADD-alog of strategies in pharma

Journal of computer-aided molecular design, 2017-03, Vol.31 (3), p.245-247

Warr, Wendy A.

2017

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Many InChIs and quite some feat

Journal of computer-aided molecular design, 2015-08, Vol.29 (8), p.681-694

Warr, Wendy A.

2015

Volltextzugriff (PDF)

Representation of chemical structures

Wiley interdisciplinary reviews. Computational molecular science, 2011-07, Vol.1 (4), p.557-579

Warr, Wendy A.

2011

Volltextzugriff (PDF)

Blowing a breath of fresh share on data

Journal of computer-aided molecular design, 2016-12, Vol.30 (12), p.1143-1147

Warr, Wendy A.

2016

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MOOCers and shakers and chemistry course takers

Journal of computer-aided molecular design, 2016-04, Vol.30 (4), p.281-284

Warr, Wendy A.

2016

Volltextzugriff (PDF)

Social software: fun and games, or business tools?

Journal of information science, 2008-08, Vol.34 (4), p.591-604

Warr, Wendy A.

2008

Volltextzugriff (PDF)

App-etite for change

Journal of computer-aided molecular design, 2015-04, Vol.29 (4), p.297-303

Warr, Wendy A.

2015

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Tautomerism in chemical information management systems

Journal of computer-aided molecular design, 2010-06, Vol.24 (6-7), p.497-520

Warr, Wendy A.

2010

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Fragment-based drug discovery

Journal of computer-aided molecular design, 2009-08, Vol.23 (8), p.453-458

Warr, Wendy A.

2009

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Data sharing matters

Journal of computer-aided molecular design, 2014, Vol.28 (1), p.1-4

Warr, Wendy A.

2014

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Data sharing as an issue

Journal of computer-aided molecular design, 2014-10, Vol.28 (10), p.973-974

Warr, Wendy A.

2014

Volltextzugriff (PDF)

Protein Data Bank Japan (PDBj): an interview with Haruki Nakamura of Osaka University

Journal of computer-aided molecular design, 2011-09, Vol.25 (9), p.791-793

Warr, Wendy A.

2011

Volltextzugriff (PDF)

Silver threads

Journal of computer-aided molecular design, 2012, Vol.26 (1), p.151-152

Warr, Wendy A.

2012

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Collaboration, competition, validation and plans for the future: An interview with Gerard Kleywegt, Head of the Protein Data Bank in Europe

Journal of computer-aided molecular design, 2010-11, Vol.24 (11), p.887-890

Warr, Wendy A.

2010

Volltextzugriff (PDF)

Fragment-based drug discovery: what really works. An interview with Sandy Farmer of Boehringer Ingelheim

Journal of computer-aided molecular design, 2011-07, Vol.25 (7), p.599-605

Warr, Wendy A.

2011

Volltextzugriff (PDF)

Some Trends in Chem(o)informatics

Methods in molecular biology (Clifton, N.J.), 2011-01, Vol.672, p.1

Warr, Wendy A

2011

Volltextzugriff (PDF)

Herman Skolnik award symposium honoring Yvonne Martin

Journal of computer-aided molecular design, 2009-12, Vol.23 (12), p.831-836

Warr, Wendy A.

2009

Volltextzugriff (PDF)

Future structural genomics initiatives: an interview with Helen Berman, director of the Protein Data Bank

Journal of computer-aided molecular design, 2008-10, Vol.22 (10), p.707-710

Warr, Wendy A.

2008

Volltextzugriff (PDF)

EndNote X (and XI) for Windows

Journal of chemical information and modeling, 2008-01, Vol.48 (1), p.242-244

Warr, Wendy A

2008

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A grand vision for configurable science and minimizing the loss model

Journal of computer-aided molecular design, 2008-08, Vol.22 (8), p.587-591

Warr, Wendy A.

2008

Volltextzugriff (PDF)

RIP MDL information systems. Is this really the beginning of a new era?

Journal of computer-aided molecular design, 2008-05, Vol.22 (5), p.327-331

Warr, Wendy A.

2008

Volltextzugriff (PDF)

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Scientific workflow systems: Pipeline Pilot and KNIME

A Short Review of Chemical Reaction Database Systems, Computer-Aided Synthesis Design, Reaction Prediction and Synthetic Feasibility

Exploration of Ultralarge Compound Collections for Drug Discovery

ChEMBL. An interview with John Overington, team leader, chemogenomics at the European Bioinformatics Institute Outstation of the European Molecular Biology Laboratory (EMBL-EBI)

A CADD-alog of strategies in pharma

Many InChIs and quite some feat

Representation of chemical structures

Blowing a breath of fresh share on data

MOOCers and shakers and chemistry course takers

Social software: fun and games, or business tools?

App-etite for change

Tautomerism in chemical information management systems

Fragment-based drug discovery

Data sharing matters

Data sharing as an issue

Protein Data Bank Japan (PDBj): an interview with Haruki Nakamura of Osaka University

Silver threads

Collaboration, competition, validation and plans for the future: An interview with Gerard Kleywegt, Head of the Protein Data Bank in Europe

Fragment-based drug discovery: what really works. An interview with Sandy Farmer of Boehringer Ingelheim

Some Trends in Chem(o)informatics

Herman Skolnik award symposium honoring Yvonne Martin

Future structural genomics initiatives: an interview with Helen Berman, director of the Protein Data Bank

EndNote X (and XI) for Windows

A grand vision for configurable science and minimizing the loss model

RIP MDL information systems. Is this really the beginning of a new era?

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