International



 

2012

LASZLO T.,

PUTZ M.V.

"On Quantitative Structure-Toxicity Relationships (QSTR) using High Chemical Diversity Molecules Group"

Journal of Theoretical and Computational Chemistry, April 2012 000-000

URL: http://www.worldscinet.com/jtcc/jtcc.shtml

 

2011

PUTZ M.V.,

LAZEA M.,

PUTZ A.M.,

SEIMAN-DUDA C.

"Introducing Catastrophe-QSAR. Application on Modeling Molecular Mechanisms of Pyridinone Derivative-Type HIV Non-Nucleoside Reverse Transcriptase Inhibitors"

Int J. Mol. Sci., 12(12) (2011) 9533-9569;

DOI: 10.3390/ijms12129533 

URL: http://www.mdpi.com/1422-0067/12/12/9533/  

ORI O.,

CATALDO F.,

PUTZ M.V.

"Topological Anisotropy of Stone-Wales Waves in Graphenic Fragments"

International Journal of Molecular Sciences, 12(11) (2011) 7934-7949;

DOI: 10.3390/ijms12117934

URL: http://www.mdpi.com/1422-0067/12/11/7934/

PUTZ M.V.,

IONAȘCU C.,

PUTZ A.M.,

OSTAFE V.

"Alert-QSAR. Implications for Electrophilic Theory of Chemical Carcinogenesis"

International Journal of Molecular Sciences, 12(8) (2011) 5098-5134;

DOI: 10.3390/ijms12085098

URL: http://www.mdpi.com/1422-0067/12/8/5098/

PUTZ M.V.,

LAZEA M.,

SANDJO L.P.

"Quantitative Structure Inter-Activity Relationship (QSInAR). Cytotoxicity Study of Some Hemisynthetic and Isolated Natural Steroids and Precursors on Human Fibrosarcoma Cells HT1080"

Molecules, 16(8) (2011) 6603-6620;

DOI: 10.3390/molecules16086603

URL: http://www.mdpi.com/1420-3049/16/8/6603/

MATITO E.,

PUTZ M.V.

"New Link between Conceptual Density Functional Theory and Electron Delocalization"

Journal of Physical Chemistry A, 115 (45) (2011) 12459-12462;

DOI: 10.1021/jp200731d (included in the Special Issue: Richard F. W. Bader Festschrift)

URL: http://pubs.acs.org/doi/abs/10.1021/jp200731d

PUTZ M.V.

"Residual-QSAR. Implications for Genotoxic Carcinogenesis"

Chemistry Central Journal, 5 (2011) 29 (11 pages);

DOI: 10.1186/1752-153X-5-29

URL: http://www.journal.chemistrycentral.com/content/5/1/29

PUTZ M.V.

"On Reducible Character of Haldane-Radić Enzyme Kinetics to Conventional and Logistic Michaelis-Menten Models"

Molecules, 16(4) (2011) 3128-3145;

DOI:10.3390/molecules16043128

URL: http://www.mdpi.com/1420-3049/16/4/3128/

PUTZ M.V.

"Chemical Action Concept and Principle"

MATCH Communications in Mathematical and in Computer Chemistry, 66(1) (2011) 35-63;

URL: http://www.pmf.kg.ac.rs/match/content66n1.htm

DUDA-SEIMAN D., AVRAM S., MANCAS S., CAREJA V., DUDA-SEIMAN C., PUTZ M.V., CIUBOTARIU D.

"MTD-CoMSIA Modeling of HMG-CoA Reductase Inhibitors"

Journal of Serbian Chemical Society, 76(1) (2011) 85-99;

DOI: 10.2298/JSC100601019D.

URL: http://www.shd.org.rs/JSCS/Vol76/No1/09_4798_4102.pdf

 

2010

PUTZ M.V.

"The Bondons: The Quantum Particles of the Chemical Bond"

International Journal of Molecular Sciences, 11(11) (2010) 4227-4256;

DOI: 10.3390/ijms11114227;

URL: http://www.mdpi.com/1422-0067/11/11/4227

PUTZ M.V.

"On Heisenberg Uncertainty Relationship, Its Extension, and the Quantum Issue of Wave-Particle Duality"

International Journal of Molecular Sciences, 11(10) (2010) 4124-4139;

DOI:  10.3390/ijms11104124;

URL: http://www.mdpi.com/1422-0067/11/10/4124

PUTZ M.V.

"Compactness Aromaticity of Atoms in Molecules"

International Journal of Molecular Sciences, 11(4) (2010) 1269-1310;

DOI: 10.3390/ijms11041269 

URL: http://www.mdpi.com/1422-0067/11/4/1269

PUTZ M.V.

"On Absolute Aromaticity within Electronegativity and Chemical Hardness Reactivity Pictures"

MATCH-Communications in Mathematical and in Computer Chemistry, 64(2) (2010) 391-418;

URL: http://www.pmf.kg.ac.rs/match/content64n2.htm

LASZLO T.,

PUTZ M.V.

"On Electronegativity and Chemical Hardness Relationships with Aromaticity"

Journal of Mathematical Chemistry, 47(1) (2010) 487-495;

DOI: 10.1007/s10910-009-9585-6;

URL: http://www.springerlink.com/content/f81757qmh225m8v1/

 

2009

PUTZ M.V.,

PUTZ A.M.,

LAZEA M.,

CHIRIAC A.

"Spectral vs. Statistic Approach of Structure-Activity Relationship. Application on Ecotoxicity of Aliphatic Amines"

Journal of Theoretical and Computational Chemistry, 8(6) (2009) 1235-1251;

DOI: 10.1142/S0219633609005453;

URL: http://www.worldscinet.com/jtcc/08/0806/S0219633609005453.html

PUTZ M.V.

"Path Integrals for Electronic Densities, Reactivity Indices, and Localization Functions in Quantum Systems"

International Journal of Molecular Sciences, 10(11) (2009) 4816-4940;

DOI: 10.3390/ijms10114816;

URL: http://www.mdpi.com/1422-0067/10/11/4816

CHICU S.A.,

PUTZ M.V.

"Köln-Timişoara Molecular Activity Combined Models toward Interspecies Toxicity Assessment"

International Journal of Molecular Sciences, 10(10) (2009) 4474-4497;

DOI: 10.3390/ijms10104474;

URL: http://www.mdpi.com/1422-0067/10/10/4474

SELEGEAN M.,

PUTZ M.V.,

RUGEA T.

"Effect of the Polysaccharide Extract from the Edible Mushroom Pleurotus Ostreatus against
Infectious Bursal Disease Virus"

International Journal of Molecular Sciences, 10(8) (2009) 3616-3634;

DOI: 10.3390/ijms10083616; 

URL: http://www.mdpi.com/1422-0067/10/8/3616

PUTZ M.V.

"Chemical Action and Chemical Bonding"

Journal of Molecular Structure: THEOCHEM, 900 (1-3) (2009) 64-70;

DOI: 10.1016/j.theochem.2008.12.026 

URL: http://dx.doi.org/10.1016/j.theochem.2008.12.026

PUTZ M.V.,

PUTZ A.M.,

LAZEA M.,

IENCIU L.,

CHIRIAC A.

"Quantum-SAR Extension of the Spectral-SAR Algorithm. Application to Polyphenolic Anticancer Bioactivity"

International Journal of Molecular Sciences, 10(3) (2009) 1193-1214;

DOI: 10.3390/ijms10031193; 

URL: http://www.mdpi.com/1422-0067/10/3/1193

PUTZ M.V.

"Electronegativity: Quantum Observable"

International Journal of Quantum Chemistry, 109 (4) (2009) 733-738;

DOI: 10.1002/qua.21957;

URL: http://www3.interscience.wiley.com/journal/121531030/abstract

 

2008

PUTZ M.V. 

"Maximum Hardness Index of Quantum Acid-Base Bonding"

MATCH - Communications in Mathematical and in Computer Chemistry, 60(3) (2008) 845-868;

URL: http://www.pmf.kg.ac.rs/match/content60n3.htm

PUTZ M.V.

"Density Functionals of Chemical Bonding"

International Journal of Molecular Sciences, 9(6) (2008) 1050-1095;

DOI: 10.3390/ijms9061050;

URL: http://www.mdpi.com/1422-0067/9/6/1050

 

2007

LACRĂMĂ A.-M.,

PUTZ M.V.,

OSTAFE V.

"A Spectral-SAR Model for the Anionic-Cationic Interaction in Ionic Liquids:
Application to Vibrio fischeri Ecotoxicity"

International Journal of Molecular Sciences, 8(8) (2007) 842-863;

DOI: 10.3390/i8080842 

URL: http://www.mdpi.com/1422-0067/8/8/842

PUTZ M.V.,

LACRĂMĂ A.-M.

"Introducing Spectral Structure Activity Relationship (S-SAR) Analysis. Application to Ecotoxicology"

International Journal of Molecular Sciences, 8(5) (2007) 363-391;

DOI: 10.3390/i8050363;

URL: http://www.mdpi.com/1422-0067/8/5/363

PUTZ M.V.

"Semiclassical Electronegativity and Chemical Hardness"

Journal of Theoretical and Computational Chemistry, 6(1) (2007) 33-47;

DOI: 10.1142/S0219633607002861;

URL: http://www.worldscinet.com/jtcc/06/0601/S0219633607002861.html

 

2006

DUDA-SEIMAN C., DUDA-SEIMAN D., DRAGOŞ D.,
MEDELEANU M., CAREJA V., PUTZ M.V., LACRĂMĂ A.-M., CHIRIAC A., NUŢIU R., CIUBOTARIU D.

"Design of Anti-HIV Ligands by Means of Minimal Topological Difference (MTD) Method"

International Journal of Molecular Sciences, 7(11) (2006) 537-555;

DOI: 10.3390/i7110537;

URL: http://www.mdpi.com/1422-0067/7/11/537 

PUTZ M.V.,

LACRĂMĂ A.-M.,

OSTAFE V.

"Full Analytic Progress Curves of the Enzymic Reactions in Vitro"

International Journal of Molecular Sciences, 7(11) (2006) 469-484;

DOI: 10.3390/i7110469;

URL: http://www.mdpi.com/1422-0067/7/11/469

 PUTZ M.V.

"Systematic Formulation for Electronegativity and Hardness and Their Atomic Scales within Density Functional Softness Theory"

International Journal of Quantum Chemistry, 106(2) (2006) 361-389; 

DOI: 10.1002/qua.20787;

URL: http://www3.interscience.wiley.com/cgi-bin/abstract/112093056/START

 

2005

PUTZ M.V. 

"Markovian Approach of the Electron Localization Functions"

International Journal of Quantum Chemistry, 105(1) (2005) 1-11;

DOI: 10.1002/qua.20645;

URL: http://www3.interscience.wiley.com/cgi-bin/abstract/110497907/START

PUTZ M.V.,

RUSSO N.,

SICILIA E.

"About the Mulliken Electronegativity in DFT"

Theoretical Chemistry Accounts, 114(1-3) (2005) 38-45;

DOI: 10.1007/s00214-005-0641-4; 

URL: http://www.springerlink.com/content/r5q2791060262416/ 

 

2004

PUTZ M.V.,

RUSSO N.,

SICILIA E.

"On the Application of the HSAB Principle through the Use of Improved Computational Schemes for Chemical Hardness Evaluation"

Journal of Computational Chemistry, 25(7) (2004) 994-1003;

DOI: 10.1002/jcc.20027;

URL: http://www3.interscience.wiley.com/cgi-bin/abstract/107637137/START

 

2003

PUTZ M.V.

"Electronic Density from Structure Factor Determination in Small Deformed Crystals"

International Journal of Quantum Chemistry, 94(4) (2003) 222-231;

DOI: 10.1002/qua.10475;

URL: http://www3.interscience.wiley.com/cgi-bin/abstract/104543091/START

PUTZ M.V.,

RUSSO N.,

SICILIA E.

"Atomic Radii Scale and Related Size Properties from Density Functional Electronegativity Formulation"

Journal of Physical Chemistry A, 107(28) (2003) 5461-5465;

DOI: 10.1021/jp027492h;

URL: http://pubs.acs.org/doi/abs/10.1021/jp027492h?prevSearch=&searchHistoryKey

 

2002

KLEINERT H.,

PELSTER A.,

PUTZ M.V.

"Variational Perturbation Theory for Markov Processes"

Physical Review E, 65(6) (2002) 066128/1-7;

DOI: 10.1103/PhysRevE.65.066128

URL: http://link.aps.org/abstract/PRE/v65/e066128