GalaxyRefine2: simultaneous refinement of inaccurate local regions and overall protein structure
… protein structures simultaneously by iterative conformational sampling, unlike GalaxyRefine,
which was limited to local refinement… (18) and CASP13 refinement experiments. This server …
which was limited to local refinement… (18) and CASP13 refinement experiments. This server …
[HTML][HTML] Methods for the refinement of protein structure 3D models
R Adiyaman, LJ McGuffin - International journal of molecular sciences, 2019 - mdpi.com
… The amino acid sequence and a 3D model (in Protein Data Bank (PDB) format) of the target
are the only required inputs to refine protein structures and the method has recently been …
are the only required inputs to refine protein structures and the method has recently been …
[HTML][HTML] Hybrid methods for combined experimental and computational determination of protein structure
JT Seffernick, S Lindert - The Journal of chemical physics, 2020 - pubs.aip.org
… to fully establish the structure of a protein. These data are … the structure, but are also often
simultaneously ambiguous (not … to refine the structures of both soluble and membrane proteins …
simultaneously ambiguous (not … to refine the structures of both soluble and membrane proteins …
AnglesRefine: refinement of 3D protein structures using Transformer based on torsion angles
… refine protein structures based on their secondary structures and torsion angles. The process
begins by identifying inconsistent local structures … : simultaneous refinement of inaccurate …
begins by identifying inconsistent local structures … : simultaneous refinement of inaccurate …
Fast and effective protein model refinement using deep graph neural networks
… Critical Assessment of Structure Prediction refinement targets, our … Our method may refine
one protein model within ~11 min on … the global lDDT and residue-wise lDDT simultaneously. …
one protein model within ~11 min on … the global lDDT and residue-wise lDDT simultaneously. …
[HTML][HTML] Improved protein structure refinement guided by deep learning based accuracy estimation
… successful refinement protocols in the recent blind 13th Critical Assessment of Structure …
Rosetta based protein structure refinement. Our approach is schematically outlined in Fig. 1. …
Rosetta based protein structure refinement. Our approach is schematically outlined in Fig. 1. …
[HTML][HTML] Non-uniform refinement: adaptive regularization improves single-particle cryo-EM reconstruction
… refinement algorithms often systematically under-fit and over-fit different regions of a 3D
structure simultaneously. This causes a loss of resolvable detail in some parts of a structure and …
structure simultaneously. This causes a loss of resolvable detail in some parts of a structure and …
[HTML][HTML] Automated cryo-EM structure refinement using correlation-driven molecular dynamics
… It is therefore fair to say that no available cryo-EM refinement method simultaneously meets
… automated yet accurate method for structure refinement and validation, denoted correlation-…
… automated yet accurate method for structure refinement and validation, denoted correlation-…
Efficient ensemble refinement by reweighting
J Köfinger, LS Stelzl, K Reuter… - Journal of chemical …, 2019 - ACS Publications
Ensemble refinement produces structural ensembles of flexible and dynamic biomolecules
by integrating experimental data and molecular simulations. Here we present two efficient …
by integrating experimental data and molecular simulations. Here we present two efficient …
Assembling multidomain protein structures through analogous global structural alignments
… and side chain refinement. For 3 or more domain assemblies, a global structural refinement
… If we simply implement the CL and cryo-EM restraints simultaneously, the model quality can …
… If we simply implement the CL and cryo-EM restraints simultaneously, the model quality can …
相关搜索
- protein structure prediction
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- protein structure models high resolution refinement
- ensemble refinement protein crystal structures
- template based protein structure modeling
- protein structures and interactions
- progressive assembly multi-domain protein structures
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- determination of protein structure