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| Rights | Preview | Issue Date | Title | Author(s) | Type |
| closedAccess |  | 2008 | [1,2,3]Triazolo[1,5-a]pyridines. A theoretical (DFT) study of the ring-chain isomerization | Blanco, Fernando; Alkorta, Ibon CSIC ORCID ; Elguero, José CSIC ORCID; Cruz, Víctor L. CSIC ORCID; Abarca, B.; Ballesteros, R. | artículo |
| closedAccess |  | 11-Jun-2014 | 3D-QSAR as a Tool for Understanding and Improving Single-Site Polymerization Catalysts. A Review | Cruz, Víctor L. CSIC ORCID; Martínez, Sonia; Ramos, Javier CSIC ORCID ; Martínez-Salazar, Javier CSIC ORCID | artículo |
| openAccess |  | 22-Nov-2009 | 3D-QSAR tools for the structure-activity analisys of single site polymerization catalysts | Cruz, Víctor L. CSIC ORCID; Ramos, Javier CSIC ORCID ; Martínez-Salazar, Javier CSIC ORCID | comunicación de congreso |
| closedAccess |  | 2012 | A Curtin-Hammett mechanism for the copolymerization of ethylene and methyl acrylate monomer using a PymNox nickel catalyst as revealed by DFT computational studies | Ramos, Javier CSIC ORCID ; Martínez, Sonia; Cruz, Víctor L. CSIC ORCID; Martínez-Salazar, Javier CSIC ORCID | artículo |
| openAccess |  | 2010 | Acceso simplificado a infraestructuras de cálculo | Cruz, Víctor L. CSIC ORCID; Ramos, Javier CSIC ORCID ; Vega, Juan Francisco CSIC ORCID; Martínez-Salazar, Javier CSIC ORCID | artículo |
| closedAccess |  | 24-Sep-2018 | Approaching short time dynamics of polymer solutions by passive microrheology | Vega, Juan Francisco CSIC ORCID; Espasa Valdepeñas, A.; Cruz, Víctor L. CSIC ORCID; Ramos, F. J.; Müller, A.J.; Martínez-Salazar, Javier CSIC ORCID | comunicación de congreso |
| closedAccess |  | 2013 | Bacteriocin AS-48 binding to model membranes and pore formation as revealed by coarse-grained simulations | Cruz, Víctor L. CSIC ORCID; Ramos, Javier CSIC ORCID ; Melo, Manuel N.; Martínez-Salazar, Javier CSIC ORCID | artículo |
| closedAccess |  | 2014 | Computer simulations of the early stages of crystal nucleation of linear and short chain branched polyethylene on carbon nanotubes | Jerónimo, K.; Cruz, Víctor L. CSIC ORCID; Ramos, Javier CSIC ORCID ; Vega, Juan Francisco CSIC ORCID; Trujillo, Mariana; Müller, Alejandro J.; Martínez-Salazar, Javier CSIC ORCID | artículo |
| closedAccess |  | 26-Oct-2016 | Conformational analysis of short polar side-chain amino-acids through umbrella sampling and DFT calculations | Ramos, Javier CSIC ORCID ; Cruz, Víctor L. CSIC ORCID | artículo |
| openAccess |  | 13-Mar-2013 | Conformational flexibility of the ErbB2 ectodomain and trastuzumab antibody complex as revealed by molecular dynamics and principal component analysis | Franco-Gonzalez, Juan Felipe CSIC ORCID ; Ramos, Javier CSIC ORCID ; Cruz, Víctor L. CSIC ORCID; Martínez-Salazar, Javier CSIC ORCID | artículo |
| closedAccess | | 25-Jan-2010 | Density functional study for the polymerization of ethylene monomer using a new nickel catalyst | Ramos, Javier CSIC ORCID ; Cruz, Víctor L. CSIC ORCID; Martínez-Salazar, Javier CSIC ORCID; Brasse, Mikaël CSIC; Palma, Pilar CSIC ORCID; Cámpora, Juan CSIC ORCID | artículo |
| openAccess |  | 14-Mar-2013 | Diosgenone synthesis, anti-malarial activity and QSAR of analogues of this natural product | Pabón, Adriana; Escobar, Gustavo; Vargas, Esteban; Cruz, Víctor L. CSIC ORCID; Notario, Rafael CSIC ORCID; Blair, Silvia; Echeverri, Fernando | artículo |
| closedAccess |  | 2011 | Dissimilar interaction of CB1/CB2 with lipid bilayers as revealed by molecular dynamics simulation | Ramos, Javier CSIC ORCID ; Cruz, Víctor L. CSIC ORCID; Martínez-Salazar, Javier CSIC ORCID; Campillo, Nuria E. CSIC ORCID ; Páez, Juan A. CSIC ORCID | artículo |
| openAccess |  | 1-Sep-1996 | Distribution and diffusivity of a hydrophobic probe molecule in the interior of a membrane: theory and simulation | Huertas, M. L.; Cruz, Víctor L. CSIC ORCID; Cascales, J. J.; Acuña, A. Ulises CSIC; García de la Torre, José | artículo |
| openAccess |  | 7-Feb-2005 | Ethylene-styrene copolymerization with constrained geometry catalysts: A density functional study | Ramos, Javier CSIC ORCID ; Muñoz-Escalona, A.; Martínez, S.; Martínez-Salazar, Javier CSIC ORCID; Cruz, Víctor L. CSIC ORCID | artículo |
| closedAccess |  | 2014 | Exploring the dynamics and interaction of a full ErbB2 receptor and Trastuzumab-Fab antibody in a lipid bilayer model using Martini coarse-grained force field. | Franco-Gonzalez, Juan Felipe CSIC ORCID ; Ramos, Javier CSIC ORCID ; Cruz, Víctor L. CSIC ORCID; Martínez-Salazar, Javier CSIC ORCID | artículo |
| openAccess |  | 1-Mar-2019 | Hydrodynamic and Electrophoretic Properties of Trastuzumab/HER2 Extracellular Domain Complexes as Revealed by Experimental Techniques and Computational Simulations | Ramos, Javier CSIC ORCID ; Vega, Juan Francisco CSIC ORCID; Cruz, Víctor L. CSIC ORCID; Sánchez-Sánchez, E.; Cortés, J.; Martínez-Salazar, Javier CSIC ORCID | artículo |
| openAccess |  | 2013 | Interaction between Trastuzumab and ErbB2 analyzed by molecular dynamics simulation | Cruz, Víctor L. CSIC ORCID; Franco-Gonzalez, Juan Felipe CSIC ORCID ; Ramos, Javier CSIC ORCID ; Martínez-Salazar, Javier CSIC ORCID | comunicación de congreso |
| closedAccess |  | 19-Jun-2017 | Molecular and hydrodynamic properties of human epidermal growth factor receptor HER2 extracellular domain and its homodimer: Experiments and multi-scale simulations | Vega, Juan Francisco CSIC ORCID; Ramos, Javier CSIC ORCID ; Cruz, Víctor L. CSIC ORCID; Vicente-Alique, E.; Sánchez-Sánchez, E.; Sánchez-Fernández, A.; Wang, Y.; Hu, P.; Cortés, J.; Martínez-Salazar, Javier CSIC ORCID | artículo |
| openAccess |  | 16-Nov-2015 | Multiscale Simulation to Understand the Bactericidal Action of the AS-48 Antimicrobial Peptide Description | Cruz, Víctor L. CSIC ORCID; Ramos, Javier CSIC ORCID ; Martínez-Salazar, Javier CSIC ORCID | póster de congreso |
