Projects
FISHING - Fishing falcipain hit inhibitors from Malaria Boxes: in silico target deconvolution model development and validation (EXPL/QEQ-COM/0927/2013)
CoordinatorFundação para a Ciência e a Tecnologia
Malaria Virtual screening pharmacophore, docking and MD simulations Falcipains inhibitionHEDICIN - HEterocycle-DIpeptide-CINnamic acid conjugates as novel antimalarials (PTDC/QUI-QUI/116864/2010)
Local CoordinatorFundação para a Ciência e a Tecnologia
malaria blood-schizontocidals falcipain inhibition hemozoin biomineralizationPublications
2D and 3D QSAR studies of diarylpyrimidine HIV-1 reverse transcriptase inhibitors
Rebehmed, J; Barbault, F; Teixeira, C; Maurel, F
2008, JOURNAL OF COMPUTER-AIDED MOLECULAR DESIGN, 22, 11, 831-841.
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Flexible computational docking studies of new aminoglycosides targeting RNA 16S bacterial ribosome site
Barbault, F; Ren, B; Rebehmed, J; Teixeira, C; Luo, Y; Smila-Castro, O; Maurel, F; Fan, BT; Zhang, LR; Zhang, LH
2008, EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY, 43, 8, 1648-1656.
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Molecular modeling studies of N-substituted pyrrole derivatives - Potential HIV-1 gp41 inhibitors
Teixeira, C; Barbault, F; Rebehmed, J; Liu, K; Xie, L; Lu, H; Jiang, SB; Fan, BT; Maurel, F
2008, BIOORGANIC & MEDICINAL CHEMISTRY, 16, 6, 3039-3048.
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Synthesis, characterization and catalytic studies of bis(chloro)dioxomolybdenum(VI)-chiral diimine complexes
Gago, S; Rodriguez-Borges, JE; Teixeira, C; Santos, AM; Zhao, J; Pillinger, M; Nunes, CD; Petrovski, Z; Santos, TM; Kuhn, FE; Romao, CC; Goncalves, IS
2005, JOURNAL OF MOLECULAR CATALYSIS A-CHEMICAL, 236, 1-2, 1-6.
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Inclusion complex formation of diferrocenyldimethylsilane with beta-cyclodextrin
Fernandes, JA; Lima, S; Braga, SS; Ribeiro-Claro, P; Rodriguez-Borges, JE; Teixeira, C; Pillinger, M; Teixeira-Dias, JJC; Goncalves, IS
2005, JOURNAL OF ORGANOMETALLIC CHEMISTRY, 690, 21-22, 4801-4808.
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