Three-dimensional quantitative structure-activity relationship of human immunodeficiency virus (I) protease inhibitors. 2. Predictive power using limited exploration of alternate binding modes

Protease Inhibitors ◽

Predictive Power ◽

Three Dimensional ◽

Binding Modes ◽

Quantitative Structure ◽

Structure Activity ◽

Immunodeficiency Virus ◽

Molecular modeling studies of human immunodeficiency virus type 1 protease inhibitors using three-dimensional quantitative structure-activity relationship, virtual screening, and docking simulations

Journal of Chemometrics ◽

10.1002/cem.2809 ◽

2016 ◽

Vol 30 (9) ◽

pp. 523-536 ◽

Cited By ~ 4

Author(s):

Jianbo Tong ◽

Pei Zhan ◽

Min Bai ◽

Tuanli Yao

Keyword(s):

Molecular Modeling ◽

Three Dimensional ◽

Quantitative Structure ◽

Docking Simulations ◽

Structure Activity ◽

Immunodeficiency Virus ◽

Molecular Modeling Studies

The use of ladder particle swarm optimisation for quantitative structure–activity relationship analysis of human immunodeficiency virus-1 integrase inhibitors

Molecular Simulation ◽

10.1080/08927022.2011.586347 ◽

2011 ◽

Vol 37 (15) ◽

pp. 1221-1233 ◽

Cited By ~ 3

Author(s):

Mehdi Jalali-Heravi ◽

Heshmatollah Ebrahimi-Najafabadi

Keyword(s):

Activity Relationship ◽

Quantitative Structure ◽

Integrase Inhibitors ◽

Relationship Analysis ◽

Structure Activity ◽

Immunodeficiency Virus ◽

Human Immunodeficiency Virus 1

Cytotoxic Activity and Three-Dimensional Quantitative Structure Activity Relationship of 2-Aryl-1,8-naphthyridin-4-ones

Korean Journal of Physiology and Pharmacology ◽

10.4196/kjpp.2009.13.6.511 ◽

2009 ◽

Vol 13 (6) ◽

pp. 511 ◽

Cited By ~ 2

Author(s):

Yong Jin Kim ◽

Eun Ae Kim ◽

Mi Lyang Chung ◽

Chaeuk Im

Keyword(s):

Cytotoxic Activity ◽

Three Dimensional ◽

Activity Relationship ◽

Quantitative Structure ◽

Structure Activity ◽

Three-Dimensional Quantitative Structure−Activity Relationship Study on Cyclic Urea Derivatives as HIV-1 Protease Inhibitors: Application of Comparative Molecular Field Analysis†

Journal of Medicinal Chemistry ◽

10.1021/jm980369n ◽

1999 ◽

Vol 42 (2) ◽

pp. 249-259 ◽

Cited By ~ 53

Author(s):

Asim Kumar Debnath

Keyword(s):

Protease Inhibitors ◽

Three Dimensional ◽

Field Analysis ◽

Comparative Molecular Field Analysis ◽

Quantitative Structure ◽

Urea Derivatives ◽

Structure Activity ◽

Relationship Study ◽

Hiv 1

Pharmacophore model and atom-based 3D quantitative structure activity relationship (QSAR) of human immunodeficiency virus-1 (HIV-1) capsid assembly inhibitors

Journal of Biomolecular Structure and Dynamics ◽

10.1080/07391102.2020.1715258 ◽

2020 ◽

pp. 1-10 ◽

Cited By ~ 1

Author(s):

R. P. Bhole ◽

C. G. Bonde ◽

S. C. Bonde ◽

R. V. Chikhale ◽

R. D. Wavhale

Keyword(s):

Pharmacophore Model ◽

Activity Relationship ◽

Capsid Assembly ◽

Quantitative Structure ◽

Structure Activity ◽

Immunodeficiency Virus ◽

Hiv 1 ◽

Human Immunodeficiency Virus 1

Study on the Three-dimensional Quantitative Structure-activity Relationship of Pyridazinonyl-substituted 1,3,4-Thiadiazoles

Chinese Journal of Chemistry ◽

10.1002/cjoc.200591120 ◽

2005 ◽

Vol 23 (8) ◽

pp. 1120-1122 ◽

Cited By ~ 4

Author(s):

Zou Xia-Juan ◽

Lai Lu-Hua ◽

Jin Gui-Yu

Keyword(s):

Three Dimensional ◽

Activity Relationship ◽

Quantitative Structure ◽

Structure Activity ◽

Quantitative Structure-Activity Relationship of some HIV-1 Protease Inhibitors: A Fujita-Ban Type Analysis

Journal of Enzyme Inhibition ◽

10.1080/14756360109162368 ◽

2001 ◽

Vol 16 (3) ◽

pp. 185-197 ◽

Cited By ~ 1

Author(s):

S. B. Mekapati ◽

R. Sivakumar ◽

S. P. Gupta

Keyword(s):

Protease Inhibitors ◽

Activity Relationship ◽

Quantitative Structure ◽

Type Analysis ◽

Structure Activity ◽

Relationship Of ◽

Hiv 1

Three-Dimensional Quantitative Structure-Activity Relationship of ArylalkylamineN-acetyltransferase (AANAT) Inhibitors: A Comparative Molecular Field Analysis

Quantitative Structure-Activity Relationships ◽

10.1002/1521-3838(200112)20:5/6<414::aid-qsar414>3.0.co;2-v ◽

2001 ◽

Vol 20 (5-6) ◽

pp. 414-421 ◽

Cited By ~ 2

Author(s):

Philippe Chavatte ◽

Saïd Yous ◽

Nathalie Beaurain ◽

Christophe Mésangeau ◽

Gilles Ferry ◽

...

Keyword(s):

Three Dimensional ◽

Field Analysis ◽

Molecular Field ◽

Activity Relationship ◽

Comparative Molecular Field Analysis ◽

Quantitative Structure ◽

Structure Activity ◽

3D-QSAR(Three-Dimensional Quantitative Structure)-Activity Relationship Of Angiotensin-Converting Enzyme And Thermolysin Inhibitors. II. A Comparison Of CoMFA Models Incorporating Molecular Orbital Fields And Desolvation Free Energies Based On Active-Analog And Complementary-Receptor-Field Alignment Rules

Journal of Medicinal Chemistry ◽

10.1021/jm00068a017 ◽

1993 ◽

Vol 36 (16) ◽

pp. 2390-2403 ◽

Cited By ~ 54

Author(s):

Chris L. Waller ◽

Garland R. Marshall

Keyword(s):

Three Dimensional ◽

3D Qsar ◽

Converting Enzyme ◽

Quantitative Structure ◽

Free Energies ◽

Receptor Field ◽

Active Analog ◽

Structure Activity ◽

ChemInform Abstract: Preparation and Structure-Activity Relationship of Novel P1/P1′- Substituted Cyclic Urea-Based Human Immunodeficiency Virus Type-1 Protease Inhibitors.

ChemInform ◽

10.1002/chin.199637224 ◽

2010 ◽

Vol 27 (37) ◽

pp. no-no

Author(s):

D. A. NUGIEL ◽

K. JACOBS ◽

T. WORLEY ◽

M. PATEL ◽

R. F. III KALTENBACH ◽

...

Keyword(s):

Protease Inhibitors ◽

Human Immunodeficiency Virus Type ◽

Virus Type ◽

Activity Relationship ◽

Structure Activity ◽

Immunodeficiency Virus ◽