41
TITLE: Fluorinated synthetic anion carriers: experimental and computational insights into transmembrane chloride transport
AUTHORS: Spooner, MJ; Li, HY; Igor Marques ; Costa, PMR; Wu, X; Howe, ENW; Busschaert, N; Moore, SJ; Light, ME; Sheppard, DN; Felix, V; Gale, PA;
PUBLISHED: 2019, SOURCE: CHEMICAL SCIENCE, VOLUME: 10, ISSUE: 7
INDEXED IN: Scopus WOS CrossRef: 14
42
TITLE: Directing self-assembly in solution towards improved cooperativity in Fe(iii) complexes with amphiphilic tridentate ligands  Full Text
AUTHORS: Ana I Vicente; Xinwey W Wu; Yannick Ortin; Liliana P Ferreira; Maria de Deus Carvalho; Sara Realista; Andrew Barker; Grace G Morgan; Nuno Galamba; Paulo J Costa; Maria Jose Calhorda; Paulo N Martinho;
PUBLISHED: 2019, SOURCE: DALTON TRANSACTIONS, VOLUME: 48, ISSUE: 13
INDEXED IN: Scopus WOS
43
TITLE: Halogen bonding in halocarbon-protein complexes and computational tools for rational drug design
AUTHORS: Costa, PJ; Nunes, Rafael ; Vila Vicosa, D;
PUBLISHED: 2019, SOURCE: EXPERT OPINION ON DRUG DISCOVERY, VOLUME: 14, ISSUE: 8
INDEXED IN: Scopus WOS CrossRef: 10
44
TITLE: Tackling halogenated species in biomolecular systems with force field methods: MD sampling and PBSA solvation energies  Full Text
AUTHORS: Costa, PJ; Vila Vicosa, D; Nunes, Rafael ;
PUBLISHED: 2019, SOURCE: Joint 12th EBSA European Biophysics Congress / 10th IUPAP International Conference on Biological Physics (ICBP) in EUROPEAN BIOPHYSICS JOURNAL WITH BIOPHYSICS LETTERS, VOLUME: 48
INDEXED IN: WOS
45
TITLE: Improved modeling of halogen-protein interactions in biomolecular simulations using a GROMOS force field  Full Text
AUTHORS: Nunes, Rafael ; Vila Vicosa, D; Machuqueiro, M; Costa, PJ;
PUBLISHED: 2019, SOURCE: Joint 12th EBSA European Biophysics Congress / 10th IUPAP International Conference on Biological Physics (ICBP) in EUROPEAN BIOPHYSICS JOURNAL WITH BIOPHYSICS LETTERS, VOLUME: 48
INDEXED IN: WOS
46
TITLE: Folding of cyclic peptides stabilized by halogen bonds  Full Text
AUTHORS: Vila Vicosa, D; Nunes, Rafael ; Costa, PJ;
PUBLISHED: 2019, SOURCE: Joint 12th EBSA European Biophysics Congress / 10th IUPAP International Conference on Biological Physics (ICBP) in EUROPEAN BIOPHYSICS JOURNAL WITH BIOPHYSICS LETTERS, VOLUME: 48
INDEXED IN: WOS
47
TITLE: Tackling Halogenated Species with PBSA: Effect of Emulating the sigma-Hole  Full Text
AUTHORS: Nunes, Rafael ; Vila Vicosa, D; Costa, PJ;
PUBLISHED: 2019, SOURCE: JOURNAL OF CHEMICAL THEORY AND COMPUTATION, VOLUME: 15, ISSUE: 7
INDEXED IN: WOS CrossRef: 4
49
TITLE: In silico design of halogenated carbohydrate mimetics as potential halogen-bonding ligands
AUTHORS: Nunes, Rafael ; Nuno M Xavier; Paulo J Costa;
PUBLISHED: 2019, SOURCE: Proceedings of MOL2NET 2018, International Conference on Multidisciplinary Sciences, 4th edition
INDEXED IN: CrossRef
50
TITLE: Tailoring Functional Chitosan-Based Composites for Food Applications  Full Text
AUTHORS: Claudia Nunes; Manuel A Coimbra; Paula Ferreira;
PUBLISHED: 2018, SOURCE: CHEMICAL RECORD, VOLUME: 18, ISSUE: 7-8
INDEXED IN: WOS
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