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Development of Ecom50 and Retention Index Models for Nontargeted Metabolomics: Identification of 1,3-Dicyclohexylurea in Human Serum by HPLC/Mass Spectrometry

Journal of chemical information and modeling, 2012-05, Vol.52 (5), p.1222-1237

2012

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Three new consensus QSAR models for the prediction of Ames genotoxicity

Mutagenesis, 2004-09, Vol.19 (5), p.365-377

2004

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Prediction of aqueous solubility based on large datasets using several QSPR models utilizing topological structure representation

Chemistry & biodiversity, 2004-11, Vol.1 (11), p.1829-1841

2004

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Issues in representation of molecular structure: The development of molecular connectivity

Journal of molecular graphics & modelling, 2001, Vol.20 (1), p.4-18

2001

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Modeling Blood-Brain Barrier Partitioning Using the Electrotopological State

Journal of Chemical Information and Computer Sciences, 2002-05, Vol.42 (3), p.651-666

2002

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A Structure-Information Approach to the Prediction of Biological Activities and Properties

Chemistry & biodiversity, 2004-01, Vol.1 (1), p.183-201

Hall, Lowell H.

2004

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QSAR Modeling Based on Structure-Information for Properties of Interest in Human Health

SAR and QSAR in environmental research, 2005-02, Vol.16 (1-2), p.13-41

2005

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QSAR modeling of beta-lactam binding to human serum proteins

Journal of computer-aided molecular design, 2003-02, Vol.17 (2-4), p.103-118

2003

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An electrotopological-state index for atoms in molecules

Pharmaceutical research, 1990-08, Vol.7 (8), p.801-807

1990

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35% drive current improvement from recessed-SiGe drain extensions on 37 nm gate length PMOS

Digest of Technical Papers. 2004 Symposium on VLSI Technology, 2004, 2004, p.48-49

2004

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E-State Modeling of Fish Toxicity Independent of 3D Structure Information

SAR and QSAR in environmental research, 2003-04, Vol.14 (2), p.113-129

2003

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The E-State as the Basis for Molecular Structure Space Definition and Structure Similarity

Journal of Chemical Information and Computer Sciences, 2000-05, Vol.40 (3), p.784-791

2000

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QSAR modeling with the electrotopological state indices: corticosteroids

Journal of computer-aided molecular design, 1998-11, Vol.12 (6), p.557-561

1998

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Modeling Drug Albumin Binding Affinity with E-State Topological Structure Representation

Journal of Chemical Information and Computer Sciences, 2003-11, Vol.43 (6), p.2120-2128

2003

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The Prediction of ADMET Properties Using Structure Information Representations

Chemistry & biodiversity, 2005-11, Vol.2 (11), p.1428-1437

2005

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E-state fields: applications to 3D QSAR

Journal of computer-aided molecular design, 1996-12, Vol.10 (6), p.513-520

1996

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Intermolecular Accessibility: The Meaning of Molecular Connectivity

Journal of Chemical Information and Computer Sciences, 2000-05, Vol.40 (3), p.792-795

2000

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Consumers and families as partners in implementing evidence-based practice

Psychiatric Clinics of North America, 2003-12, Vol.26 (4), p.867-881

2003

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Modeling the toxicity of amide herbicides using the electrotopological state

Environmental toxicology and chemistry, 1999-05, Vol.18 (5), p.1069-1075

1999

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Molecular connectivity: intermolecular accessibility and encounter simulation

Journal of molecular graphics & modelling, 2001-01, Vol.20 (1), p.76-83

2001

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Database Organization and Searching with E-State Indices

SAR and QSAR in environmental research, 2001-01, Vol.12 (1-2), p.55-74

2001

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E-State Modeling of HIV-1 Protease Inhibitor Binding Independent of 3D Information

Journal of Chemical Information and Computer Sciences, 2002-03, Vol.42 (2), p.290-298

2002

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Matched-field processing using measured replica fields

The Journal of the Acoustical Society of America, 2000-02, Vol.107 (2), p.739-746

2000

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Boiling Point and Critical Temperature of a Heterogeneous Data Set: QSAR with Atom Type Electrotopological State Indices Using Artificial Neural Networks

Journal of Chemical Information and Computer Sciences, 1996-09, Vol.36 (5), p.1004-1014

1996

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An index of electrotopological state for atoms in molecules

Journal of mathematical chemistry, 1991-12, Vol.7 (1), p.229-241

1991

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Development of Ecom50 and Retention Index Models for Nontargeted Metabolomics: Identification of 1,3-Dicyclohexylurea in Human Serum by HPLC/Mass Spectrometry

Three new consensus QSAR models for the prediction of Ames genotoxicity

Prediction of aqueous solubility based on large datasets using several QSPR models utilizing topological structure representation

Issues in representation of molecular structure: The development of molecular connectivity

Modeling Blood-Brain Barrier Partitioning Using the Electrotopological State

A Structure-Information Approach to the Prediction of Biological Activities and Properties

QSAR Modeling Based on Structure-Information for Properties of Interest in Human Health

QSAR modeling of beta-lactam binding to human serum proteins

An electrotopological-state index for atoms in molecules

35% drive current improvement from recessed-SiGe drain extensions on 37 nm gate length PMOS

E-State Modeling of Fish Toxicity Independent of 3D Structure Information

The E-State as the Basis for Molecular Structure Space Definition and Structure Similarity

QSAR modeling with the electrotopological state indices: corticosteroids

Modeling Drug Albumin Binding Affinity with E-State Topological Structure Representation

The Prediction of ADMET Properties Using Structure Information Representations

E-state fields: applications to 3D QSAR

Intermolecular Accessibility: The Meaning of Molecular Connectivity

Consumers and families as partners in implementing evidence-based practice

Modeling the toxicity of amide herbicides using the electrotopological state

Molecular connectivity: intermolecular accessibility and encounter simulation

Database Organization and Searching with E-State Indices

E-State Modeling of HIV-1 Protease Inhibitor Binding Independent of 3D Information

Matched-field processing using measured replica fields

Boiling Point and Critical Temperature of a Heterogeneous Data Set: QSAR with Atom Type Electrotopological State Indices Using Artificial Neural Networks

An index of electrotopological state for atoms in molecules

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