Modeling Tracer Diffusion Coefficients of Any Type of Solutes in Polar and Non-Polar Dense Solvents

por Zêzere, Bruno, Portugal, Inês, Gomes, José R. B., Silva, Carlos M.
Publicado 2022

Cinnamic Derivatives as Antitubercular Agents: Characterization by Quantitative Structure–Activity Relationship Studies

por Teixeira, Cátia, Ventura, Cristina, Gomes, José R. B., Gomes, Paula, Martins, Filomena
Publicado 2020

New Force-Field for Organosilicon Molecules in the Liquid Phase

por Jorge, Miguel, Milne, Andrew W., Barrera, Maria Cecilia, Gomes, José R. B.
Publicado 2021

Striking HIV-1 Entry by Targeting HIV-1 gp41. But, Where Should We Target?

por Teixeira, Cátia, Barbault, Florent, Couesnon, Thierry, Gomes, José R. B., Gomes, Paula, Maurel, François
Publicado 2016

Correction to “New Force-Field for Organosilicon Molecules in the Liquid Phase”

por Jorge, Miguel, Stavert, Tom, Milne, Andrew W., Barrera, Maria Cecilia, Gomes, José R. B.
Publicado 2022

MXenes à la Carte: Tailoring the Epitaxial Growth Alternating Nitrogen and Transition Metal Layers

por Gouveia, José D., Morales-García, Ángel, Viñes, Francesc, Gomes, José R. B., Illas, Francesc
Publicado 2022

Molecular Dynamics Model to Explore the Initial Stages of Anion Exchange involving Layered Double Hydroxide Particles

por Novell Leruth, Gerard, Kuznetsova, Alena, Tedim, João, Gomes, José R. B., Galvão, Tiago L. P.
Publicado 2022

Solubilities of Amino Acids in Aqueous Solutions of Chloride or Nitrate Salts of Divalent (Mg(2+) or Ca(2+)) Cations

por Aliyeva, Mehriban, Brandão, Paula, Gomes, José R. B., Coutinho, João A. P., Ferreira, Olga, Pinho, Simão P.
Publicado 2022

Layered double hydroxides for corrosion-related applications—Main developments from 20 years of research at CICECO

por Tedim, João, Galvão, Tiago L. P., Yasakau, Kiryl A., Bastos, Alexandre, Gomes, José R. B., Ferreira, Mario G. S.
Publicado 2022

Influence of Ethanol Parametrization on Diffusion Coefficients Using OPLS-AA Force Field

por Zêzere, Bruno, Fonseca, Tiago V. B., Portugal, Inês, Simões, Mário M. Q., Silva, Carlos M., Gomes, José R. B.
Publicado 2023

Unravelling moisture-induced CO(2) chemisorption mechanisms in amine-modified sorbents at the molecular scale

por Sardo, Mariana, Afonso, Rui, Juźków, Joanna, Pacheco, Marlene, Bordonhos, Marta, Pinto, Moisés L., Gomes, José R. B., Mafra, Luís
Publicado 2021