Understanding the comparative molecular field analysis (CoMFA) in terms of molecular quantum similarity and DFT-based reactivity descriptors

Reactivity Descriptors ◽

Molecular Quantum Similarity

Comparative molecular field analysis of CCK-A antagonists using field-fit as an alignment technique. A convenient guide to design new CCK-A ligands

Journal of Computer-Aided Molecular Design ◽

10.1007/bf00126214 ◽

1992 ◽

Vol 6 (6) ◽

pp. 553-568 ◽

Cited By ~ 11

Author(s):

Sylvain Rault ◽

Ronan Bureau ◽

Juan Carlos Pilo ◽

Max Robba

Keyword(s):

Field Analysis ◽

Molecular Field ◽

Alignment Technique

Comparative Molecular Field Analysis of Compounds with CYP2A5 Binding Affinity

Quantitative Structure-Activity Relationships ◽

10.1002/qsar.19950140603 ◽

1995 ◽

Vol 14 (6) ◽

pp. 507-511 ◽

Cited By ~ 11

Author(s):

Antti Poso ◽

Risto Juvonen ◽

Jukka Gynther

Keyword(s):

Binding Affinity ◽

Field Analysis ◽

Molecular Field ◽

3D-QSAR studies on 4-hydroxyphenylpyruvate dioxygenase inhibitors by comparative molecular field analysis (CoMFA)

Bioorganic & Medicinal Chemistry Letters ◽

10.1016/s0960-894x(02)00432-8 ◽

2002 ◽

Vol 12 (17) ◽

pp. 2271-2275 ◽

Cited By ~ 18

Author(s):

Meilan Huang ◽

Ding-Yah Yang ◽

Zhicai Shang ◽

Jianwei Zou ◽

Qingsen Yu

Keyword(s):

3D Qsar ◽

Field Analysis ◽

Molecular Field ◽

Qsar Studies ◽

Application of comparative molecular field analysis to dopamine d2 partial agonists

Bioorganic & Medicinal Chemistry ◽

10.1016/s0968-0896(99)00201-1 ◽

1999 ◽

Vol 7 (11) ◽

pp. 2453-2456 ◽

Cited By ~ 3

Author(s):

Georgia B McGaughey ◽

Richard E Mewshaw

Keyword(s):

Field Analysis ◽

Molecular Field ◽

Partial Agonists ◽

Dopamine D2

Melatonin Receptor Ligands: Synthesis of New Melatonin Derivatives and Comprehensive Comparative Molecular Field Analysis (CoMFA) Study

Journal of Medicinal Chemistry ◽

10.1021/jm9810093 ◽

1998 ◽

Vol 41 (20) ◽

pp. 3831-3844 ◽

Cited By ~ 51

Author(s):

Marco Mor ◽

Silvia Rivara ◽

Claudia Silva ◽

Fabrizio Bordi ◽

Pier Vincenzo Plazzi ◽

...

Keyword(s):

Field Analysis ◽

Molecular Field ◽

Melatonin Receptor ◽

Receptor Ligands ◽

Comfa Study

Different electrostatic descriptors in comparative molecular field analysis: A comparison of molecular electrostatic and coulomb potentials

Journal of Computational Chemistry ◽

10.1002/(sici)1096-987x(199608)17:11<1296::aid-jcc2>3.0.co;2-h ◽

1996 ◽

Vol 17 (11) ◽

pp. 1296-1308 ◽

Cited By ~ 21

Author(s):

Romano T. Kroemer ◽

Peter Hecht ◽

Klaus R. Liedl

Keyword(s):

Field Analysis ◽

Molecular Field ◽

Coulomb Potentials

Comparative Molecular Field Analysis of Multidrug Resistance Modifiers

Molecular Modeling and Prediction of Bioactivity ◽

10.1007/978-1-4615-4141-7_102 ◽

2000 ◽

pp. 414-415

Author(s):

Ilza K. Pajeva ◽

Michael Wiese

Keyword(s):

Multidrug Resistance ◽

Field Analysis ◽

Molecular Field ◽

Antitumor evaluation and 3D-QSAR studies of a new series of the spiropyrroloquinoline isoindolinone/aza-isoindolinone derivatives by comparative molecular field analysis (CoMFA)

Molecular Diversity ◽

10.1007/s11030-017-9778-z ◽

2017 ◽

Vol 21 (4) ◽

pp. 821-830 ◽

Cited By ~ 1

Author(s):

Masoud Sadeghzadeh ◽

Maryam Salahinejad ◽

Nahid Zarezadeh ◽

Mehdi Ghandi ◽

Maryam Keshavarz Baghery

Keyword(s):

3D Qsar ◽

Field Analysis ◽

Molecular Field ◽

Qsar Studies ◽

Antitumor Evaluation

On the Prediction of the Enantioselectivity of Candida rugosa Lipase by Comparative Molecular Field Analysis

Biocatalysis ◽

10.3109/10242429408992122 ◽

1994 ◽

Vol 9 (1-4) ◽

pp. 227-239 ◽

Cited By ~ 11

Author(s):

K. Faber ◽

H. Griengl ◽

H. Hönig ◽

J. Zuegg

Keyword(s):

Candida Rugosa ◽

Candida Rugosa Lipase ◽

Field Analysis ◽

Molecular Field ◽

Novel ligands for the human histamine H1 receptor: Synthesis, pharmacology, and comparative molecular field analysis studies of 2-dimethylamino-5-(6)-phenyl-1,2,3,4-tetrahydronaphthalenes

Bioorganic & Medicinal Chemistry ◽

10.1016/j.bmc.2006.05.077 ◽

2006 ◽

Vol 14 (19) ◽

pp. 6640-6658 ◽

Cited By ~ 22

Author(s):

Ola M. Ghoneim ◽

Jacqueline A. Legere ◽

Alexander Golbraikh ◽

Alexander Tropsha ◽

Raymond G. Booth

Keyword(s):

Field Analysis ◽

Molecular Field ◽

H1 Receptor ◽

Histamine H1 Receptor ◽

Human Histamine