Quantum-chemical-based quantitative structure-activity relationships for estimation of CO 2 absorption/desorption capacities of amine-based absorbents

International Journal of Greenhouse Gas Control ◽

10.1016/j.ijggc.2016.03.022 ◽

2016 ◽

Vol 49 ◽

pp. 372-378 ◽

Author(s):

Girma Gonfa ◽

Mohamad Azmi Bustam ◽

Azmi M. Shariff

Keyword(s):

Quantum Chemical ◽

Quantitative Structure ◽

Structure Activity Relationships ◽

Structure Activity ◽

Quantitative Structure Activity Relationships

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ChemInform Abstract: QUANTITATIVE STRUCTURE-ACTIVITY RELATIONSHIPS EMPLOYING INDEPENDENT QUANTUM CHEMICAL INDEXES

Chemischer Informationsdienst ◽

10.1002/chin.198350357 ◽

1983 ◽

Vol 14 (50) ◽

Author(s):

I. LUKOVITS

Keyword(s):

Quantum Chemical ◽

Quantitative Structure ◽

Structure Activity Relationships ◽

Structure Activity ◽

Quantitative Structure Activity Relationships

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Quantitative structure-activity relationships employing independent quantum chemical indexes

Journal of Medicinal Chemistry ◽

10.1021/jm00362a003 ◽

1983 ◽

Vol 26 (8) ◽

pp. 1104-1109 ◽

Author(s):

Istvan Lukovits

Keyword(s):

Quantum Chemical ◽

Quantitative Structure ◽

Structure Activity Relationships ◽

Structure Activity ◽

Quantitative Structure Activity Relationships

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Quantitative Structure-Activity Relationships on MAO Substrates by Means of Quantum Chemical Properties

Quantitative Structure-Activity Relationships ◽

10.1002/qsar.19860050204 ◽

1986 ◽

Vol 5 (2) ◽

pp. 54-57 ◽

Author(s):

F. Sanz ◽

M. MartinÌ ◽

F. LapeÃ±a ◽

F. Manaut

Keyword(s):

Quantum Chemical ◽

Chemical Properties ◽

Quantitative Structure ◽

Structure Activity Relationships ◽

Structure Activity ◽

Quantitative Structure Activity Relationships

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Frontier orbital energies in quantitative structure-activity relationships: A comparison of quantum chemical methods

Theoretica Chimica Acta ◽

10.1007/bf01127805 ◽

1994 ◽

Vol 87 (6) ◽

pp. 415-430 ◽

Author(s):

Brian W. Clare

Keyword(s):

Quantum Chemical ◽

Quantitative Structure ◽

Frontier Orbital ◽

Chemical Methods ◽

Structure Activity Relationships ◽

Orbital Energies ◽

Structure Activity ◽

Quantum Chemical Methods ◽

Quantitative Structure Activity Relationships

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Carbonic anhydrase inhibitors — Part 47: Quantum chemical quantitative structure-activity relationships for a group of sulfanilamide Schiff base inhibitors of carbonic anhydrase

European Journal of Medicinal Chemistry ◽

10.1016/s0223-5234(98)80049-4 ◽

1998 ◽

Vol 33 (6) ◽

pp. 489-500 ◽

Author(s):

Claudiu T. Supuran ◽

Brian W. Clare

Keyword(s):

Schiff Base ◽

Carbonic Anhydrase ◽

Quantum Chemical ◽

Quantitative Structure ◽

Carbonic Anhydrase Inhibitors ◽

Structure Activity Relationships ◽

Structure Activity ◽

Quantitative Structure Activity Relationships

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Quantitative Structure-Activity Relationships of Potential Antimalarial Drugs Active Against Chloroquine-Resistant Plasmodium Falciparum

Planta Medica ◽

10.1055/s-2008-1075144 ◽

2008 ◽

Vol 74 (03) ◽

Author(s):

SJ Hocart ◽

H Liu ◽

D De ◽

FM Krogstad ◽

DJ Krogstad

Keyword(s):

Plasmodium Falciparum ◽

Antimalarial Drugs ◽

Quantitative Structure ◽

Structure Activity Relationships ◽

Structure Activity ◽

Quantitative Structure Activity Relationships

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Parabolic Quantitative Structure–Activity Relationships and Photodynamic Therapy: Application of a Three-Compartment Model with Clearance to the In Vivo Quantitative Structure–Activity Relationships of a Congeneric Series of Pyropheophorbide Derivatives Used as Photosensitizers for Photodynamic Therapy

Photochemistry and Photobiology ◽

10.1562/0031-8655(1999)070<0781:pqsrap>2.3.co;2 ◽

1999 ◽

Vol 70 (5) ◽

pp. 781 ◽

Author(s):

W. R. Potter ◽

B. W. Henderson ◽

D. A. Bellnier ◽

R. K. Pandey ◽

L. A. Vaughan ◽

...

Keyword(s):

Photodynamic Therapy ◽

Compartment Model ◽

Quantitative Structure ◽

Structure Activity Relationships ◽

Structure Activity ◽

Three Compartment Model ◽

Quantitative Structure Activity Relationships

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Binding Affinity of Triphenyl Acrylonitriles to Estrogen Receptors: Quantitative Structure-Activity Relationships

Folia Medica ◽

10.2478/v10153-010-0005-2 ◽

2010 ◽

Vol 52 (3) ◽

Author(s):

Sorana Bolboacă ◽

Monica Marta ◽

Lorentz Jäntschi

Keyword(s):

Estrogen Receptors ◽

Binding Affinity ◽

Quantitative Structure ◽

Structure Activity Relationships ◽

Structure Activity ◽

Quantitative Structure Activity Relationships

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Quantitative Structure-Activity Relationships for Cellular Uptake of Surface-Modified Nanoparticles

Combinatorial Chemistry & High Throughput Screening ◽

10.2174/1386207318666150306105525 ◽

2015 ◽

Vol 18 (4) ◽

pp. 365-375 ◽

Author(s):

Rong Liu ◽

Robert Rallo ◽

Muhammad Bilal ◽

Yoram Cohen

Keyword(s):

Cellular Uptake ◽

Quantitative Structure ◽

Structure Activity Relationships ◽

Structure Activity ◽

Quantitative Structure Activity Relationships ◽

Surface Modified ◽

Surface Modified Nanoparticles

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Investigation of the Structural Requirement for Blocking the Human CCR5 Chemokine Receptor. An Insight from Quantitative Structure Activity Relationships Study

Letters in Drug Design & Discovery ◽

10.2174/157018009787582615 ◽

2009 ◽

Vol 6 (2) ◽

pp. 114-124 ◽

Author(s):

Nigus Dessalew

Keyword(s):

Chemokine Receptor ◽

Quantitative Structure ◽

Structural Requirement ◽

Ccr5 Chemokine Receptor ◽

Structure Activity Relationships ◽

Structure Activity ◽

Quantitative Structure Activity Relationships ◽

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