Methods for the refinement of protein structure 3D models
R Adiyaman, LJ McGuffin - International journal of molecular sciences, 2019 - mdpi.com
The refinement of predicted 3D protein models is crucial in bringing them closer towards
experimental accuracy for further computational studies. Refinement approaches can be …
experimental accuracy for further computational studies. Refinement approaches can be …
MUFOLD: A new solution for protein 3D structure prediction
There have been steady improvements in protein structure prediction during the past 2
decades. However, current methods are still far from consistently predicting structural …
decades. However, current methods are still far from consistently predicting structural …
Improvement of 3D protein models using multiple templates guided by single-template model quality assessment
MT Buenavista, DB Roche, LJ McGuffin - Bioinformatics, 2012 - academic.oup.com
Motivation: Modelling the 3D structures of proteins can often be enhanced if more than one
fold template is used during the modelling process. However, in many cases, this may also …
fold template is used during the modelling process. However, in many cases, this may also …
Template based protein structure modeling by global optimization in CASP 11
For the template‐based modeling (TBM) of CASP11 targets, we have developed three new
protein modeling protocols (nns for server prediction and LEE and LEER for human …
protein modeling protocols (nns for server prediction and LEE and LEER for human …
The Protein Model Portal—a comprehensive resource for protein structure and model information
J Haas, S Roth, K Arnold, F Kiefer, T Schmidt… - Database, 2013 - academic.oup.com
Abstract The Protein Model Portal (PMP) has been developed to foster effective use of 3D
molecular models in biomedical research by providing convenient and comprehensive …
molecular models in biomedical research by providing convenient and comprehensive …
Progress and challenges in high‐resolution refinement of protein structure models
KMS Misura, D Baker - Proteins: Structure, Function, and …, 2005 - Wiley Online Library
Achieving atomic level accuracy in de novo structure prediction presents a formidable
challenge even in the context of protein models with correct topologies. High‐resolution …
challenge even in the context of protein models with correct topologies. High‐resolution …
Protein structure prediction and model quality assessment
A Kryshtafovych, K Fidelis - Drug discovery today, 2009 - Elsevier
Protein structures have proven to be a crucial piece of information for biomedical research.
Of the millions of currently sequenced proteins only a small fraction is experimentally solved …
Of the millions of currently sequenced proteins only a small fraction is experimentally solved …
Template-based protein structure modeling
A Fiser - Computational biology, 2010 - Springer
Functional characterization of a protein is often facilitated by its 3D structure. However, the
fraction of experimentally known 3D models is currently less than 1% due to the inherently …
fraction of experimentally known 3D models is currently less than 1% due to the inherently …
Experimental accuracy in protein structure refinement via molecular dynamics simulations
Refinement is the last step in protein structure prediction pipelines to convert approximate
homology models to experimental accuracy. Protocols based on molecular dynamics (MD) …
homology models to experimental accuracy. Protocols based on molecular dynamics (MD) …
3D-Jury: a simple approach to improve protein structure predictions
Motivation: Consensus structure prediction methods (meta-predictors) have higher accuracy
than individual structure prediction algorithms (their components). The goal for the …
than individual structure prediction algorithms (their components). The goal for the …