Mecanismo de acción de moléculas con actividad biológica ; Mechanisms of action of biolocally active compounds
Moabac
Centro de Biología Molecular Severo Ochoa
Madrid, EspañaCentro de Biología Molecular Severo Ochoa -ko ikertzaileekin lankidetzan egindako argitalpenak (15)
2024
-
Flexible structural arrangement and DNA-binding properties of protein p6 from Bacillus subtillis phage ϕ29
Nucleic Acids Research, Vol. 52, Núm. 4, pp. 2045-2065
2020
-
Generation of endoplasmic reticulum stress and inhibition of autophagy by plitidepsin induces proteotoxic apoptosis in cancer cells
Biochemical Pharmacology, Vol. 172
2014
-
ALFA: Automatic ligand flexibility assignment
Journal of Chemical Information and Modeling, Vol. 54, Núm. 1, pp. 314-323
2013
-
A structure-based design of new C2- and C13-substituted taxanes: Tubulin binding affinities and extended quantitative structure-activity relationships using comparative binding energy (COMBINE) analysis
Organic and Biomolecular Chemistry, Vol. 11, Núm. 18, pp. 3046-3056
-
Comparison of ultra-fast 2D and 3D ligand and target descriptors for side effect prediction and network analysis in polypharmacology
British Journal of Pharmacology, Vol. 170, Núm. 3, pp. 557-567
2012
-
A reverse combination of structure-based and ligand-based strategies for virtual screening
Journal of Computer-Aided Molecular Design, Vol. 26, Núm. 3, pp. 319-327
-
AtlasCBS: A web server to map and explore chemico-biological space
Journal of Computer-Aided Molecular Design, Vol. 26, Núm. 9, pp. 995-1003
-
CRDOCK: An ultrafast multipurpose protein-ligand docking tool
Journal of Chemical Information and Modeling, Vol. 52, Núm. 8, pp. 2300-2309
-
MM-ISMSA: An ultrafast and accurate scoring function for protein-protein docking
Journal of Chemical Theory and Computation, Vol. 8, Núm. 9, pp. 3395-3408
-
Rationale for the opposite stereochemistry of the major monoadducts and interstrand crosslinks formed by mitomycin C and its decarbamoylated analogue at CpG steps in DNA and the effect of cytosine modification on reactivity
Organic and Biomolecular Chemistry, Vol. 10, Núm. 8, pp. 1543-1552
-
Tubulin-based structure-affinity relationships for antimitotic Vinca alkaloids
Anti-Cancer Agents in Medicinal Chemistry, Vol. 12, Núm. 3, pp. 219-225
2011
-
VSDMIP 1.5: An automated structure- and ligand-based virtual screening platform with a PyMOL graphical user interface
Journal of Computer-Aided Molecular Design, Vol. 25, Núm. 9, pp. 813-824
2010
-
gCOMBIIME: A graphical user interface to perform structure-based comparative binding energy (COMBINE) analysis on a set of ligand-receptor complexes
Proteins: Structure, Function and Bioinformatics, Vol. 78, Núm. 1, pp. 162-172
1989
-
Complete nucleotide sequence of the hsp70 gene of T.cruzi
Nucleic Acids Research
-
Molecular cloning of a Drosophila potential Z-DNA forming sequence hybridizing in situ to a developmentally regulated subdivision of the polytene chromosomes
Nucleic Acids Research, Vol. 17, Núm. 12, pp. 4579-4588