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The Journal of Organic Chemistry|February 1, 2003
Computational insight into the reaction intermediates in the glycosylation reaction assisted by donor heteroatomsFernando Bravo, Antonio Viso, Eva Alcázar, et al.Journal of Computational Chemistry|June 3, 2024
POMSimulator: An open-source tool for predicting the aqueous speciation and self-assembly mechanisms of polyoxometalatesEnric Petrus, Jordi Buils, Diego Garay-Ruiz, et al.Chemistry (Weinheim an Der Bergstrasse, Germany)|March 27, 2015
Highly Efficient Chirality Transfer from Diamines Encapsulated within a Self-Assembled Calixarene-Salen HostLuis Martínez-Rodríguez, Nuno A G Bandeira, Carles Bo, et al.Journal of Computer-Aided Molecular Design|July 17, 2017
Binding mode prediction and MD/MMPBSA-based free energy ranking for agonists of REV-ERBα/NCoRYvonne Westermaier, Sergio Ruiz-Carmona, Isabelle Theret, et al.Inorganic Chemistry|May 22, 1996
Electronic Structure of Rh(2)(&mgr;-CO)(CO)(2)(H(2)PCH(2)PH(2))(2). An Example of a Non-A-Frame StructureCarles Bo, Miquel Costas, Josep M. Poblet, et al.Inorganic Chemistry|September 16, 2003
DFT studies of uranyl acetate, carbonate, and malonate, complexes in solutionJordi Vázquez, Carles Bo, Josep Maria Poblet, et al.Journal of Chemical Information and Modeling|August 3, 2019
Cosolvent-Based Protein Pharmacophore for Ligand Enrichment in Virtual ScreeningJuan Pablo Arcon, Lucas A Defelipe, Elias D Lopez, et al.Nature Chemistry|February 22, 2017
Dynamic undocking and the quasi-bound state as tools for drug discoverySergio Ruiz-Carmona, Peter Schmidtke, F Javier Luque, et al.Inorganic Chemistry|March 30, 2012
Influence of the solvent and metal center on supramolecular chirality induction with bisporphyrin tweezer receptors. Strong metal modulation of effective molarity valuesInmaculada C Pintre, Simon Pierrefixe, Alex Hamilton, et al.Inorganic Chemistry|August 2, 2006
Structural evolution in polyoxometalates: a DFT study of dimerization processes in Lindqvist and Keggin cluster anionsXavier López, Ira A Weinstock, Carles Bo, et al.Pageof 20