Hologram Quantitative Structure-activity Relationships Investigations of Non-nucleoside Reverse Transcriptase Inhibitors

Pornpan Pungpo, Supa Hannongbua, Peter Wolschann
September 1, 2003

A Comparative Study of Quantitative Structure-activity Relationship Methods Based on Gallic Acid Derivatives

Haishan Huang, Weili Ou, Jinbao Zhao, Di Chen, Lei Wang
April 1, 2004

Hologram Quantitative Structure Activity Relationship Studies on 5-HT6 Antagonists

Munikumar Reddy Doddareddy, Yeon Joo Lee, Yong Seo Cho, Kyung Il Choi, Hun Yeong Koh, Ae Nim Pae
July 15, 2004

A Comparative Molecular Field Analysis (CoMFA) Study Using Semiempirical, Density Functional, Ab Initio Methods and Pharmacophore Derivation Using DISCOtech on Sigma 1 Ligands

Dawoon Jung, Jie Floyd, Tamara M. Gund
August 1, 2004

Pharmacokinetics of Dibutylphthalate in Pregnant Rats

Oxford Academic
Fennell TR, Krol WL, Sumner SC, Snyder RW
December 1, 2004

QSAR Analyses on Ginkgolides and their Analogs Using CoMFA, CoMSIA, and HQSAR

Weiliang Zhu, Gang Chen, Lihong Hu, Xiaomin Luo, Chunshan Gui, Cheng Luo, Chum Mok Puah, Kaixian Chen, Hualiang Jiang
January 17, 2005

CoMFA, HQSAR, and Molecular Docking Studies of Butitaxel Analogs with β-tubulin

Suzanne L. Cunningham, Albert R. Cunningham, Billy W. Day
February 1, 2005

CoMFA, CoMSIA, and Molecular Hologram QSAR Studies of Novel Neuronal nAChRs Ligands-open Ring Analogs of 3-pyridyl Ether

Huabei Zhang, Hua Li, Chunping Liu
March 1, 2005

Techniques: Application of Systems Biology to Absorption, Distribution, Metabolism, Excretion, and Toxicity

Sean Ekins, Yuri Nikolsky, Tatiana Nikolskaya
April 1, 2005

Angiotensin II Pseudopeptides Containing 1,3,5-trisubstituted Benzene Scaffolds with High AT2 Receptor Affinity

Jennie Georgsson, Christian Sköld, Bianca Plouffe, Gunnar Lindeberg, Milad Botros, Mats Larhed, Fred Nyberg, Nicole Gallo-Payet, Adolf Gogoll, Anders Karlén, Anders Hallberg
October 20, 2005

Developing an Antituberculosis Compounds Database and Data Mining in the Search of a Motif Responsible for the Activity of a Diverse Class of Antituberculosis Agents

Om Prakash, Indira Ghosh
January 1, 2006

Two- and Three-dimensional Quantitative Structure-activity Relationships for a Series of Purine Nucleoside Phosphorylase Inhibitors

Marcelo Castilho, Matheus Postigo, Caroline de Paula, Carlos Montanari, Glaucius Oliva, Adriano Andricopulo
January 15, 2006

Structure-based Design, Synthesis, and Biological Evaluation of Novel Inhibitors of Human Cyclophilin A

Jean-François Guichou, Julien Viaud, Clément Mettling, Guy Subra, Yea-Lih Lin, Alain Chavanieu
February 9, 2006

Curcumin Induces Caspase-3-dependent Apoptotic Pathway but Inhibits DNA Fragmentation Factor 40/Caspase-activated DNase Endonuclease in Human Jurkat Cells

Ewa Sikora, Anna Bielak-Żmijewska, Adriana Magalska, Katarzyna Piwocka, Grazyna Mosieniak, Magdalena Kalinowska, Piotr Widlak, Iwona A. Cymerman, Janusz M. Bujnicki
April 1, 2006

Robust Ligand-based Modeling of the Biological Targets of Known Drugs

Ann Cleves, Ajay Jain
May 18, 2006

N1-benzoyl-N2-[1-(1-naphthyl)ethyl]-trans-1,2-diaminocyclohexanes: Development of 4-chlorophenylcarboxamide (calhex 231) as a New Calcium Sensing Receptor Ligand Demonstrating Potent Calcilytic Activity

Albane Kessler, Hélène Faure, Christophe Petrel, Didier Rognan, Michèle Césario, Martial Ruat, Philippe Dauban, Robert H. Dodd
August 24, 2006

GALAHAD: 1. Pharmacophore Identification by Hypermolecular Alignment of Ligands in 3D

Nicola J. Richmond, Charlene A. Abrams, Philippa R. N. Wolohan, Edmond Abrahamian, Peter Willett, Robert D. Clark
September 1, 2006

QSAR Analyses on Avian Influenza Virus Neuraminidase Inhibitors Using CoMFA, CoMSIA, and HQSAR

Mingyue Zheng, Kunqian Yu, Hong Liu, Xiaomin Luo, Kaixian Chen, Weiliang Zhu, Hualiang Jiang
September 1, 2006

Virtual Screening for Aryl Hydrocarbon Receptor Binding Prediction

Elena Lo Piparo, Konrad Koehler, Antonio Chana, Emilio Benfenati
September 21, 2006

Scoring Functions for Protein-ligand Docking

Ajay Jain
October 1, 2006
Learn More LinkedIn Twitter Facebook Email