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	1.	New parameterization scheme of DFT-D for graphitic materials. [electronic resource] by Strutyński, Karol Melle-Franco, Manuel Gomes, José A N F Producer: 20130913 In: The journal of physical chemistry. A vol. 117 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	2.	Accuracy of dispersion interactions in semiempirical and molecular mechanics models: the benzene dimer case. [electronic resource] by Strutyński, Karol Gomes, José A N F Melle-Franco, Manuel Producer: 20150521 In: The journal of physical chemistry. A vol. 118 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	3.	Molecular dynamics study of the calcium ion transfer across the water/nitrobenzene interface. [electronic resource] by dos Santos, Daniel J V A Gomes, José A N F Producer: 20030724 In: Chemphyschem : a European journal of chemical physics and physical chemistry vol. 3 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	4.	Some Comments on Topological Approaches to the π-Electron Currents in Conjugated Systems. [electronic resource] by Dickens, Timothy K Gomes, José A N F Mallion, Roger B Producer: 20151125 In: Journal of chemical theory and computation vol. 7 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	5.	QM/QM study of the coverage effects on the adsorption of amino-cyclopentene at the Si(100) surface. [electronic resource] by Santos, Hugo R R Ujaque, Gregori Ramos, Maria J Gomes, José A N F Producer: 20070717 In: Journal of computational chemistry vol. 27 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	6.	Molecular dynamics simulations of mouse ferrochelatase variants: what distorts and orientates the porphyrin? [electronic resource] by Szefczyk, Borys Cordeiro, M Natália D S Franco, Ricardo Gomes, José A N F Producer: 20091229 In: Journal of biological inorganic chemistry : JBIC : a publication of the Society of Biological Inorganic Chemistry vol. 14 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	7.	A computational analysis of the insertion of carbon nanotubes into cellular membranes. [electronic resource] by Höfinger, Siegfried Melle-Franco, Manuel Gallo, Tommaso Cantelli, Andrea Calvaresi, Matteo Gomes, José A N F Zerbetto, Francesco Producer: 20111129 In: Biomaterials vol. 32 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	8.	Comparative analysis of the performance of commonly available density functionals in the determination of geometrical parameters for zinc complexes. [electronic resource] by Sousa, Sérgio F Carvalho, Emanuela S Ferreira, Diana M Tavares, Isabel S Fernandes, Pedro A Ramos, Maria João Gomes, José A N F Producer: 20100226 In: Journal of computational chemistry vol. 30 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)