Predicting protein–protein interactions from the molecular to the proteome level
Identification of protein–protein interactions (PPIs) is at the center of molecular biology
considering the unquestionable role of proteins in cells. Combinatorial interactions result in …
considering the unquestionable role of proteins in cells. Combinatorial interactions result in …
A review of methods available to estimate solvent-accessible surface areas of soluble proteins in the folded and unfolded states
Solvent accessible surface area (SASA) of proteins has always been considered as a
decisive factor in protein folding and stability studies. It is defined as the surface …
decisive factor in protein folding and stability studies. It is defined as the surface …
The FTMap family of web servers for determining and characterizing ligand-binding hot spots of proteins
FTMap is a computational map** server that identifies binding hot spots of
macromolecules—ie, regions of the surface with major contributions to the ligand-binding …
macromolecules—ie, regions of the surface with major contributions to the ligand-binding …
Capturing non-local interactions by long short-term memory bidirectional recurrent neural networks for improving prediction of protein secondary structure, backbone …
Motivation The accuracy of predicting protein local and global structural properties such as
secondary structure and solvent accessible surface area has been stagnant for many years …
secondary structure and solvent accessible surface area has been stagnant for many years …
Phosphorylation in protein-protein binding: effect on stability and function
Posttranslational modifications offer a dynamic way to regulate protein activity, subcellular
localization, and stability. Here we estimate the effect of phosphorylation on protein binding …
localization, and stability. Here we estimate the effect of phosphorylation on protein binding …
Flex ddG: Rosetta ensemble-based estimation of changes in protein–protein binding affinity upon mutation
Computationally modeling changes in binding free energies upon mutation (interface ΔΔ G)
allows large-scale prediction and perturbation of protein–protein interactions. Additionally …
allows large-scale prediction and perturbation of protein–protein interactions. Additionally …
The role of conformational dynamics and allostery in modulating protein evolution
Advances in sequencing techniques and statistical methods have made it possible not only
to predict sequences of ancestral proteins but also to identify thousands of mutations in the …
to predict sequences of ancestral proteins but also to identify thousands of mutations in the …
SPIDER2: a package to predict secondary structure, accessible surface area, and main-chain torsional angles by deep neural networks
Predicting one-dimensional structure properties has played an important role to improve
prediction of protein three-dimensional structures and functions. The most commonly …
prediction of protein three-dimensional structures and functions. The most commonly …
SKEMPI: a structural kinetic and energetic database of mutant protein interactions and its use in empirical models
Motivation: Empirical models for the prediction of how changes in sequence alter protein–
protein binding kinetics and thermodynamics can garner insights into many aspects of …
protein binding kinetics and thermodynamics can garner insights into many aspects of …
Predicting protein-protein interactions on a proteome scale by matching evolutionary and structural similarities at interfaces using PRISM
Prediction of protein-protein interactions at the structural level on the proteome scale is
important because it allows prediction of protein function, helps drug discovery and takes …
important because it allows prediction of protein function, helps drug discovery and takes …