Determination of New Cu⁺, Cu²⁺, and Zn²⁺ Lennard-Jones Ion Parameters in AcetonitrileTORRAS, Juan; ALEMAN, Carlos.The Journal of physical chemistry. B. 2013, Vol 117, Num 36, pp 10513-10522, issn 1520-6106, 10 p.Article

Simulation of the Self-Assembly of Poly(α-glutamate) and Dodecyltrimethylammonium : Diffusive Role of the Surfactant CationsZANUY, David; ALEMAN, Carlos.Journal of polymer science. Part B. Polymer physics. 2008, Vol 46, Num 10, pp 917-924, issn 0887-6266, 8 p.Article

Modeling the amorphous phase of comb-like polymersCURCO, David; ALEMAN, Carlos.Journal of polymer science. Part B. Polymer physics. 2006, Vol 44, Num 6, pp 953-966, issn 0887-6266, 14 p.Article

Molecular dynamics study of complexes of poly(glutamate) and dodecyltrimethylammoniumZANUY, David; ALEMAN, Carlos.Biomacromolecules. 2007, Vol 8, Num 2, pp 663-671, issn 1525-7797, 9 p.Article

Computer experiments on crystalline nylons: structural analysis of nylons with large aliphatic segmentsALEMAN, Carlos; CASANOVAS, Jordi.Colloid and polymer science (Print). 2004, Vol 282, Num 6, pp 535-543, issn 0303-402X, 9 p.Article

A molecular orbital approach to conformational study of the polyisocyanatesALEMAN, Carlos; GREEN, Mark M.Macromolecular theory and simulations. 2001, Vol 10, Num 2, pp 100-107, issn 1022-1344Article

Simulation of amorphous nylon 6 using SuSi, a strategy based on generation-relaxation algorithmsALEMAN, Carlos; CURCO, David.Macromolecular theory and simulations. 2004, Vol 13, Num 4, pp 345-354, issn 1022-1344, 10 p.Article

Effect of the environment on the stability of surfactant-polypeptide self-assembled complexes : Molecular dynamics simulations of stoichiometric complexes formed by N-dodecyltrimethylammonium and poly(α,L-glutamate) in chloroform, methanol, and waterZANUY, David; ALEMAN, Carlos.Journal of polymer science. Part B. Polymer physics. 2006, Vol 44, Num 7, pp 1122-1133, issn 0887-6266, 12 p.Article

Binding in complex ionic systems: anticooperative effects in systems stabilized by electrostatic interactionsALEMAN, Carlos; ZANUV, David.Chemical physics letters. 2001, Vol 343, Num 3-4, pp 390-396, issn 0009-2614Article

Conducting Polymers Obtained from Quiescent and Stirred Solutions: Effects on the PropertiesSANCHEZ-JIMENEZ, Margarita; ALEMAN, Carlos; ESTRANY, Francesc et al.Polymer engineering and science. 2014, Vol 54, Num 9, pp 2121-2131, issn 0032-3888, 11 p.Article

Synergy of the I^―/I^―₃ redox pair in the capacitive properties of nanometric poly(3,4-ethylenedioxythiophene)ARADILLA, David; ESTRANY, Francesc; ALEMAN, Carlos et al.Organic electronics (Print). 2013, Vol 14, Num 1, pp 131-142, issn 1566-1199, 12 p.Article

Electroactivity, electrochemical stability and electrical conductivity of multilayered films containing poly(3,4-ethylendioxythiophene) and poly (N -methylpyrrole)ESTRANY, Francesc; ARADILLA, David; OLIVER, Ramon et al.European polymer journal. 2007, Vol 43, Num 5, pp 1876-1882, issn 0014-3057, 7 p.Article

Crystalline poly(4-methyl-1-pentene): Structure and solubility of gas moleculesZANUY, David; ALEMAN, Carlos; MUNOZ-GUERRA, Sebastian et al.Journal of polymer science. Part B. Polymer physics. 2002, Vol 40, Num 18, pp 2037-2049, issn 0887-6266Article

Ultraporous poly(3,4-ethylenedioxythiophene) for nanometric electrochemical supercapacitorARADILLA, David; ESTRANY, Francesc; ARMELIN, Elaine et al.Thin solid films. 2012, Vol 520, Num 13, pp 4402-4409, issn 0040-6090, 8 p.Article

Different Properties for Poly(3,4-ethylenedioxythiophene) Films Derived from Single or Multiple Polymerization StepsARADILLA, David; ESTRANY, Francesc; ALEMAN, Carlos et al.Journal of applied polymer science (Print). 2011, Vol 121, Num 4, pp 1982-1991, issn 0021-8995, 10 p.Article

Structural and Electronic Properties of Crown Ether Functionalized OligothiophenesCASANOVAS, Jordi; ZANUY, David; ALEMAN, Carlos et al.Macromolecules. 2008, Vol 41, Num 11, pp 3919-3924, issn 0024-9297, 6 p.Article

Water Absorption in Polyaniline Emeraldine BaseCANALES, Manel; ARADILLA, David; ALEMAN, Carlos et al.Journal of polymer science. Part B. Polymer physics. 2011, Vol 49, Num 18, pp 1322-1331, issn 0887-6266, 10 p.Article

Electronic characterization of all-thiophene conducting dendrimers: Molecules and assembliesRODRIGUEZ-ROPERO, Francisco; ZANUY, David; ALEMAN, Carlos et al.Polymer (Guildford). 2010, Vol 51, Num 1, pp 308-315, issn 0032-3861, 8 p.Article

Intrinsic Conformational Preferences of C^α,α-DibenzylglycineCASANOVAS, Jordi; NUSSINOV, Ruth; ALEMAN, Carlos et al.Journal of organic chemistry. 2008, Vol 73, Num 11, pp 4205-4211, issn 0022-3263, 7 p.Article

Morphology and growing of nanometric multilayered films formed by alternated layers of poly(3,4-ethylenedioxythiophene) and poly(N-methylpyrrole)ARADILLA, David; ESTRANY, Francesc; ARMELIN, Elaine et al.Thin solid films. 2010, Vol 518, Num 15, pp 4203-4210, issn 0040-6090, 8 p.Article

Properties of nanometric and micrometric multilayered films made of three conducting polymersARADILLA, David; ESTRANY, Francesc; OLIVER, Ramon et al.European polymer journal. 2010, Vol 46, Num 12, pp 2222-2228, issn 0014-3057, 7 p.Article

Structural and electronic effects induced by carboxylic acid substitution in isomeric 2,2'-bithiophenes and oligothiophenes : A computational studyCASANOVAS, Jordi; ZANUY, David; ALEMAN, Carlos et al.Polymer (Guildford). 2005, Vol 46, Num 22, pp 9452-9460, issn 0032-3861, 9 p.Article

A microscopic view of a helical poly(γ-peptide) : Molecular dynamics simulations of a 20-residue unionized poly(γ-D-glutamic acid) in waterZANUY, David; ALEMAN, Carlos; MUNOZ-GUERRA, Sebastian et al.Macromolecular theory and simulations. 2000, Vol 9, Num 8, pp 543-549, issn 1022-1344Article

Intrinsic conformational characteristics of α,α-diphenylglycineCASANOVAS, Jordi; ZANUY, David; NUSSINOV, Ruth et al.Journal of organic chemistry. 2007, Vol 72, Num 6, pp 2174-2181, issn 0022-3263, 8 p.Article

Ester substitution in 2,2'-bithiophene : Analyses of the changes induced in the structural and electronic propertiesOCAMPO, Cintia; ALEMAN, Carlos; CURCO, David et al.Synthetic metals. 2006, Vol 156, Num 7-8, pp 602-609, issn 0379-6779, 8 p.Article