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Journal of Computer-Aided Molecular Design, ISSN 0920-654X, 5/2011, Volume 25, Issue 5, pp. 413 - 426
The B-cell lymphoma 2 (Bcl-2) family of proteins regulates the intrinsic pathway of apoptosis. Interactions between specific anti- and pro-apoptotic Bcl-2... 
Chemistry | Conformational smapling | Helix stability | Hydrophobic clustering | Physical Chemistry | Anti-cancer drugs | Capping interactions | Peptide conformation | Peptoid inhibitors | Animal Anatomy / Morphology / Histology | Amphipathic helix | Computer Applications in Chemistry
Journal Article
Journal of Computer - Aided Molecular Design, ISSN 0920-654X, 05/2011, Volume 25, Issue 5, p. 413
The B-cell lymphoma 2 (Bcl-2) family of proteins regulates the intrinsic pathway of apoptosis. Interactions between specific anti- and pro-apoptotic Bcl-2... 
Inhibitor drugs | Peptides | Computer based modeling | Molecular biology | Pharmaceutical sciences | Cancer
Journal Article
Journal of Computer-Aided Molecular Design, ISSN 0920-654X, 05/2011, Volume 25, Issue 5, pp. 413 - 426
The B-cell lymphoma 2 (Bcl-2) family of proteins regulates the intrinsic pathway of apoptosis. Interactions between specific anti- and pro-apoptotic Bcl-2... 
Proteins | Residues | Inhibitors | Computer simulation | Peptides | Molecular dynamics | Affinity | Helical
Journal Article
ISSN 2041-6520, 2/2019, Volume 1, Issue 8, pp. 2489 - 25
Stapled-peptides have emerged as an exciting class of molecules which can modulate protein-protein interactions. We have used a structure-guided approach to... 
Journal Article
Chemical Science, ISSN 2041-6520, 01/2019, Volume 10, Issue 8, pp. 2489 - 2500
Stapled-peptides have emerged as an exciting class of molecules which can modulate protein–protein interactions. We have used a structure-guided approach to... 
Proteins | Binding | Peptides | Feature recognition | Hydrocarbons | Helicity | Crystal structure
Journal Article
Proteins: Structure, Function, and Bioinformatics, ISSN 0887-3585, 12/2015, Volume 83, Issue 12, pp. 2240 - 2250
Journal Article
Journal Article
Chemical Science, ISSN 2041-6520, 2019, Volume 10, Issue 8, pp. 2489 - 2500
Stapled-peptides have emerged as an exciting class of molecules which can modulate protein-protein interactions. We have used a structure-guided approach to... 
REFINEMENT | COMPLEX | DESIGN | STRUCTURE VALIDATION | FACTOR EIF4E | KINETICS | IN-VIVO | BINDING | CANCER | CHEMISTRY, MULTIDISCIPLINARY | SMALL-MOLECULE INHIBITION
Journal Article
Structure, ISSN 0969-2126, 09/2018, Volume 26, Issue 9, pp. 1178 - 1186.e3
Despite being initially identified in the blood filtrate, LEKTI is a 15-domain Kazal-type inhibitor mostly known in the regulation of skin desquamation. In the... 
MD simulation | Kazal | NMR | blood coagulation | factor XIa | lympho-epithelial Kazal-type related inhibitor | LEKTI | factor Xa | serine protease | SYSTEM | MOLECULAR-DYNAMICS | BIOCHEMISTRY & MOLECULAR BIOLOGY | ALGORITHMS | RESTRAINTS | CELL BIOLOGY | BIOPHYSICS | LANGEVIN | SERINE-PROTEASE INHIBITOR | SECONDARY STRUCTURE | PROTEINS | ASSOCIATION | Molecular dynamics | Thrombin | Skin | Analysis
Journal Article