AIMC Topic: Sequence Analysis, Protein

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Deep learning-driven fragment ion series classification enables highly precise and sensitive de novo peptide sequencing.

Nature communications
Unlike for DNA and RNA, accurate and high-throughput sequencing methods for proteins are lacking, hindering the utility of proteomics in applications where the sequences are unknown including variant calling, neoepitope identification, and metaproteo...

ResCNNT-fold: Combining residual convolutional neural network and Transformer for protein fold recognition from language model embeddings.

Computers in biology and medicine
A comprehensive understanding of protein functions holds significant promise for disease research and drug development, and proteins with analogous tertiary structures tend to exhibit similar functions. Protein fold recognition stands as a classical ...

Protein remote homology detection and structural alignment using deep learning.

Nature biotechnology
Exploiting sequence-structure-function relationships in biotechnology requires improved methods for aligning proteins that have low sequence similarity to previously annotated proteins. We develop two deep learning methods to address this gap, TM-Vec...

Enzyme function prediction using contrastive learning.

Science (New York, N.Y.)
Enzyme function annotation is a fundamental challenge, and numerous computational tools have been developed. However, most of these tools cannot accurately predict functional annotations, such as enzyme commission (EC) number, for less-studied protei...

iQDeep: an integrated web server for protein scoring using multiscale deep learning models.

Journal of molecular biology
The remarkable recent advances in protein structure prediction have enabled computational modeling of protein structures with considerably higher accuracy than ever before. While state-of-the-art structure prediction methods provide self-assessment c...

Evolutionary-scale prediction of atomic-level protein structure with a language model.

Science (New York, N.Y.)
Recent advances in machine learning have leveraged evolutionary information in multiple sequence alignments to predict protein structure. We demonstrate direct inference of full atomic-level protein structure from primary sequence using a large langu...

Multienzyme deep learning models improve peptide de novo sequencing by mass spectrometry proteomics.

PLoS computational biology
Generating and analyzing overlapping peptides through multienzymatic digestion is an efficient procedure for de novo protein using from bottom-up mass spectrometry (MS). Despite improved instrumentation and software, de novo MS data analysis remains ...

DeepRHD: An efficient hybrid feature extraction technique for protein remote homology detection using deep learning strategies.

Computational biology and chemistry
In computational biology, the Protein Remote homology Detection technique (PRHD) has got undeniable significance. It is mostly important for structure and function identification of a protein sequence. The previous years have seen a challenge that la...

Prediction of Disordered Regions in Proteins with Recurrent Neural Networks and Protein Dynamics.

Journal of molecular biology
The role of intrinsically disordered protein regions (IDRs) in cellular processes has become increasingly evident over the last years. These IDRs continue to challenge structural biology experiments because they lack a well-defined conformation, and ...

Positional SHAP (PoSHAP) for Interpretation of machine learning models trained from biological sequences.

PLoS computational biology
Machine learning with multi-layered artificial neural networks, also known as "deep learning," is effective for making biological predictions. However, model interpretation is challenging, especially for sequential input data used with recurrent neur...