UB Paderborn / Katalog / Suche / in CDI

Sortiert nach

Einfacher Volltextzugriff von (fast) überall

Installieren Sie die LibKey Nomad-Browsererweiterung und erhalten Sie von vielen Webseiten einfachen Zugriff auf lizenzierte Volltexte oder Open Access Publikationen. Mehr erfahren...

Structure and reaction based evaluation of synthetic accessibility

Journal of computer-aided molecular design, 2007-06, Vol.21 (6), p.311-325

2007

Volltextzugriff (PDF)

Virtual computational chemistry laboratory--design and description

Journal of computer-aided molecular design, 2005-06, Vol.19 (6), p.453-463

2005

Volltextzugriff (PDF)

Scoring Ligand Efficiency: Potency, Ligand Efficiency and Product Ligand Efficiency within Big Data Landscape

Letters in drug design & discovery, 2019-01, Vol.16 (11), p.1258-1263

2019

Volltextzugriff (PDF)

A novel workflow for the inverse QSPR problem using multiobjective optimization

Journal of computer-aided molecular design, 2006-05, Vol.20 (5), p.333-341

2006

Volltextzugriff (PDF)

An environmental perspective on large-scale genome clustering based on metabolic capabilities

Bioinformatics, 2008-08, Vol.24 (16), p.i56-i62

2008

Volltextzugriff (PDF)

De novo design and synthetic accessibility

Journal of computer-aided molecular design, 2007-06, Vol.21 (6), p.307-309

Gasteiger, Johann

2007

Volltextzugriff (PDF)

Performance of radial distribution function-based descriptors in the chemoinformatic studies of HIV-1 protease

Future medicinal chemistry, 2020-02, Vol.12 (4), p.299-309

2020

Volltextzugriff (PDF)

Modeling chemical reactions for drug design

Journal of computer-aided molecular design, 2007-01, Vol.21 (1-3), p.33-52

Gasteiger, Johann

2007

Volltextzugriff (PDF)

Leaving us with fond memories, smiles, SMILES and, alas, tears: a tribute to David Weininger, 1952–2016

Journal of computer-aided molecular design, 2018-02, Vol.32 (2), p.313-319

2018

Volltextzugriff (PDF)

The comparison of geometric and electronic properties of molecular surfaces by neural networks: application to the analysis of corticosteroid-binding globulin activity of steroids

Journal of computer-aided molecular design, 1996-12, Vol.10 (6), p.521-534

1996

Volltextzugriff (PDF)

Virtual screening applications: a study of ligand-based methods and different structure representations in four different scenarios

Journal of computer-aided molecular design, 2007-10, Vol.21 (10-11), p.617-640

2007

Volltextzugriff (PDF)

The de novo design of median molecules within a property range of interest

Journal of computer-aided molecular design, 2004-12, Vol.18 (12), p.761-771

2004

Volltextzugriff (PDF)

Linear and nonlinear functions on modeling of aqueous solubility of organic compounds by two structure representation methods

Journal of computer-aided molecular design, 2004-02, Vol.18 (2), p.75-87

2004

Volltextzugriff (PDF)

Steroid binding by antibodies and artificial receptors: exploration of theoretical methods to determine the origins of binding affinities and specificities

Journal of computer-aided molecular design, 2000-10, Vol.14 (7), p.611-629

2000

Volltextzugriff (PDF)

Schematic Sweet and Bitter Receptors

Annals of the New York Academy of Sciences, 1987-11, Vol.510 (1), p.173-175

1987

Volltextzugriff (PDF)

1 – 16 von 16

Suche als RSS-Feed

Aktive Filter

ThemaAlgorithms

KollektionJournals@Ovid Complete

SpracheEnglisch

Suchergebnisse filtern

Filter anzeigen

Nur zeigen

Geprüft (Peer-Review)
(16)
Mit Volltextzugriff
(14)

Publikationsform

Artikel
(16)

Sprache

Japanisch
(5)

Erscheinungsjahr

n.n

Thema

Science & Technology
(16)
Life Sciences & Biomedicine
(15)
Biochemistry & Molecular Biology
(13)
Computer Science
(13)
Computer Science, Interdisciplinary Applications
(13)
Technology
(13)
Biophysics
(12)
Drug Design
(9)
Molecular Structure
(7)
Ligands
(4)
Models, Chemical
(4)
Studies
(4)
Chemistry
(3)
Computer Simulation
(3)
Databases, Factual
(3)
Mathematical Models
(3)
Models, Molecular
(3)
Neural Networks
(3)
Qsar
(3)
Quantitative Structure-Activity Relationship
(3)

15 weitere anzeigen...

Weniger anzeigen...

Zeitschrift / Serie

1 weiteren anzeigen...

Weniger anzeigen...

Menü

Weitere Dienste

Einstellungen

Structure and reaction based evaluation of synthetic accessibility

Virtual computational chemistry laboratory--design and description

Scoring Ligand Efficiency: Potency, Ligand Efficiency and Product Ligand Efficiency within Big Data Landscape

A novel workflow for the inverse QSPR problem using multiobjective optimization

An environmental perspective on large-scale genome clustering based on metabolic capabilities

De novo design and synthetic accessibility

Online chemical modeling environment (OCHEM): web platform for data storage, model development and publishing of chemical information

Performance of radial distribution function-based descriptors in the chemoinformatic studies of HIV-1 protease

Modeling chemical reactions for drug design

Leaving us with fond memories, smiles, SMILES and, alas, tears: a tribute to David Weininger, 1952–2016

The comparison of geometric and electronic properties of molecular surfaces by neural networks: application to the analysis of corticosteroid-binding globulin activity of steroids

Virtual screening applications: a study of ligand-based methods and different structure representations in four different scenarios

The de novo design of median molecules within a property range of interest

Linear and nonlinear functions on modeling of aqueous solubility of organic compounds by two structure representation methods

Steroid binding by antibodies and artificial receptors: exploration of theoretical methods to determine the origins of binding affinities and specificities

Schematic Sweet and Bitter Receptors

Aktive Filter

Suchergebnisse filtern