Search Result "1D and 2D descriptors"


Applications of 2D Descriptors in Drug Design: A DRAGON Tale

Journal: Current Topics in Medicinal Chemistry
Volume: 8 Issue: 1 Year: 2008 Page: 1628-1655
Author(s): Aliuska Morales Helguera, Robert D. Combes, Maykel Perez Gonzalez, M. Natalia D.S. Cordeiro

A Review on Principles, Theory and Practices of 2D-QSAR

Journal: Current Drug Metabolism
Volume: 15 Issue: 4 Year: 2014 Page: 346-379
Author(s): Kunal Roy,Rudra Narayan Das

Recent Advances in the Assessment of Druglikeness Using 2D-Structural Descriptors

Ebook: Advances in Mathematical Chemistry and Applications Volume 1 (Revised Edition)
Volume: 1 Year: 2015
Author(s): Hariharan Rajesh,Lakshminarasimhan Rajagopalan,Vellarkad N. Viswanadhan
Doi: 10.2174/9781681081977115010016

Improving Synthetic Efficiency Using the Computational Prediction of Biological Activity

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 9 Issue: 2 Year: 2006 Page: 103-113
Author(s): K. C. Brogle, T. Gund, D. J. Kyle

Bridging Chemical and Biological Space: QSAR Probing Using 3D Molecular Descriptors

Ebook: Recent Trends on QSAR in the Pharmaceutical Perceptions
Volume: 1 Year: 2012
Author(s): M. Natália D.S. Cordeiro,Fernanda Borges,Aliuska Morales Helguera
Doi: 10.2174/978160805379711201010119

Recent Advances in the Assessment of Druglikeness Using 2DStructural Descriptors

Ebook: Advances in Mathematical Chemistry and Applications
Volume: 1 Year: 2014
Author(s): Hariharan Rajesh,Lakshminarasimhan Rajagopalan,Vellarkad N. Viswanadhan
Doi: 10.2174/9781608059287114010015

Molecular Descriptors in Chemoinformatics, Computational Combinatorial Chemistry, and Virtual Screening

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 3 Issue: 5 Year: 2000 Page: 363-372
Author(s): Ling Xue, Jurgen Bajorath

Molecular Descriptors and Methods for Ligand Based Virtual High Throughput Screening in Drug Discovery

Journal: Current Pharmaceutical Design
Volume: 12 Issue: 1 Year: 2006 Page: 2099-2110
Author(s): Alfonso Pozzan

Application of SMILES Notation Based Optimal Descriptors in Drug Discovery and Design

Journal: Current Topics in Medicinal Chemistry
Volume: 15 Issue: 18 Year: 2015 Page: 1768-1779
Author(s): Aleksandar M. Veselinovic,Jovana B. Veselinovic,Jelena V. Zivkovic,Goran M. Nikolic

Potency-Scaled Partitioning in Descriptor Spaces with Increasing Dimensionality

Journal: Current Topics in Medicinal Chemistry
Volume: 5 Issue: 8 Year: 2005 Page: 797-803
Author(s): Jurgen Bajorath

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