| 1 |
Assessment of the Intrinsic Conformational Preferences of Dipeptide Amino Acids in Aqueous Solution by Combined Umbrella Sampling/MBAR Statistics. A Comparison with Experimental Results
Cruz VL, Ramos J, Martinez-Salazar J
Journal of Physical Chemistry B, 116(1), 469, 2012 |
| 2 |
Density Functional Study for the Polymerization of Ethylene Monomer Using a New Nickel Catalyst
Ramos J, Cruz VL, Martinez-Salazar J, Brasse M, Palma P, Campora J
Journal of Polymer Science Part A: Polymer Chemistry, 48(5), 1160, 2010 |
| 3 |
Proposed polymerization termination mechanism for 3-R-indenyl ansa-zirconocenes (R = n-alkyl) based on DFT calculations and experimental observations
Cruz VL, Martinez S, Martinez-Salazar J, Sancho J
Macromolecules, 40(20), 7413, 2007 |
| 4 |
3D-QSAR study of ansa-metallocene catalytic behavior in ethylene polymerization
Cruz VL, Martinez S, Martinez-Salazar J, Polo-Ceron D, Gomez-Ruiz S, Fajardo M, Prashar S
Polymer, 48(16), 4663, 2007 |
| 5 |
QSAR model for ethylene polymerisation catalysed by supported bis(imino)pyridine iron complexes
Cruz VL, Martinez J, Martinez-Salazar J, Ramos J, Reyes ML, Toro-Labbe A, Gutierrez-Giliva S
Polymer, 48(26), 7672, 2007 |
| 6 |
Isomeric effect of the Et(H(4)Ind)(2)Zr(CH3)(2) catalyst on the copolymerization of ethylene and styrene: A computational study
Martinez S, Ramos J, Cruz VL, Martinez-Salazar J
Journal of Polymer Science Part A: Polymer Chemistry, 44(16), 4752, 2006 |
| 7 |
A QM/MM study of the ethylene and styrene insertion process into the ion pair [Me2Si(C5Me4)((NBu)-Bu-t)Ti(CH2CH2CH3)](+)[mu-Me-Al(Me)(2)-(AlOMe)(6)Me] (-)
Martinez S, Ramos J, Cruz VL, Martinez-Salazar J
Polymer, 47(3), 883, 2006 |
| 8 |
Theoretical study of the comonomer effect in the ethylene polymerization with zirconocene catalytic systems
Cruz VL, Munoz-Escalona A, Martinez-Salazar J
Journal of Polymer Science Part A: Polymer Chemistry, 36(7), 1157, 1998 |
| 9 |
Ab-Initio Calculation of Ethylene Insertion in Zirconocene Catalyst Systems - A Comparative-Study Between Bridged and Unbridged Complexes
Cruz VL, Munozescalona A, Martinezsalazar J
Polymer, 37(9), 1663, 1996 |
