GraphQA: protein model quality assessment using graph convolutional networks
Motivation Proteins are ubiquitous molecules whose function in biological processes is
determined by their 3D structure. Experimental identification of a protein's structure can be …
determined by their 3D structure. Experimental identification of a protein's structure can be …
3D-equivariant graph neural networks for protein model quality assessment
Motivation Quality assessment (QA) of predicted protein tertiary structure models plays an
important role in ranking and using them. With the recent development of deep learning end …
important role in ranking and using them. With the recent development of deep learning end …
Protein model quality assessment using 3D oriented convolutional neural networks
Motivation Protein model quality assessment (QA) is a crucial and yet open problem in
structural bioinformatics. The current best methods for single-model QA typically combine …
structural bioinformatics. The current best methods for single-model QA typically combine …
ProteinGCN: Protein model quality assessment using graph convolutional networks
Blind estimation of local (per-residue) and global (for the whole structure) accuracies in
protein structure models is an essential step in many protein modeling applications. With the …
protein structure models is an essential step in many protein modeling applications. With the …
DeepQA: improving the estimation of single protein model quality with deep belief networks
Background Protein quality assessment (QA) useful for ranking and selecting protein models
has long been viewed as one of the major challenges for protein tertiary structure prediction …
has long been viewed as one of the major challenges for protein tertiary structure prediction …
DeepUMQA: ultrafast shape recognition-based protein model quality assessment using deep learning
Motivation Protein model quality assessment is a key component of protein structure
prediction. In recent research, the voxelization feature was used to characterize the local …
prediction. In recent research, the voxelization feature was used to characterize the local …
Alphadesign: A graph protein design method and benchmark on alphafolddb
While DeepMind has tentatively solved protein folding, its inverse problem--protein design
which predicts protein sequences from their 3D structures--still faces significant challenges …
which predicts protein sequences from their 3D structures--still faces significant challenges …
QMEANDisCo—distance constraints applied on model quality estimation
G Studer, C Rempfer, AM Waterhouse… - …, 2020 - academic.oup.com
Motivation Methods that estimate the quality of a 3D protein structure model in absence of an
experimental reference structure are crucial to determine a model's utility and potential …
experimental reference structure are crucial to determine a model's utility and potential …
Improved model quality assessment using sequence and structural information by enhanced deep neural networks
J Liu, K Zhao, G Zhang - Briefings in bioinformatics, 2023 - academic.oup.com
Protein model quality assessment plays an important role in protein structure prediction,
protein design and drug discovery. In this work, DeepUMQA2, a substantially improved …
protein design and drug discovery. In this work, DeepUMQA2, a substantially improved …
DeepGraphGO: graph neural network for large-scale, multispecies protein function prediction
Motivation Automated function prediction (AFP) of proteins is a large-scale multi-label
classification problem. Two limitations of most network-based methods for AFP are (i) a …
classification problem. Two limitations of most network-based methods for AFP are (i) a …