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Protein Structure Prediction in Drug Discovery [PDF]

open access: yesBiomolecules, 2023
When the results of DeepMind’s AlphaFold2 at CASP were announced in 2020, the scientific world was so amazed by how effectively it performed that “it will change everything” became the motto for this revolution [...]
Alessandro Paiardini
doaj   +2 more sources

Conformational ensembles for protein structure prediction [PDF]

open access: yesScientific Reports
Acquisition of conformational ensembles for a protein is a challenging task, which is actually involving to the solution for protein folding problem and the study of intrinsically disordered protein.
Jiaan Yang   +9 more
doaj   +2 more sources

Protein Structure Prediction: Challenges, Advances, and the Shift of Research Paradigms [PDF]

open access: yesGenomics, Proteomics & Bioinformatics, 2023
Protein structure prediction is an interdisciplinary research topic that has attracted researchers from multiple fields, including biochemistry, medicine, physics, mathematics, and computer science.
Bin Huang   +10 more
doaj   +2 more sources

PS4: a next-generation dataset for protein single-sequence secondary structure prediction [PDF]

open access: goldBioTechniques, 2023
Protein secondary structure prediction is a subproblem of protein folding. A light-weight algorithm capable of accurately predicting secondary structure from only the protein residue sequence could provide useful input for tertiary structure prediction ...
Omar Peracha
doaj   +2 more sources

Protein Structure Prediction [PDF]

open access: yes, 2009
Práce popisuje prostorovou strukturu molekul bílkovin a databází uchovávajících representace této struktury, či její hierarchické klasifikace. Je poskytnut přehled současných metod výpočetní predikce struktury bílkovin, přičemž největší pozornost je ...
Tuček, Jaroslav
core   +3 more sources

Protein structure prediction in genomics [PDF]

open access: bronzeBriefings in Bioinformatics, 2001
As the number of completely sequenced genomes rapidly increases, including now the complete Human Genome sequence, the post-genomic problems of genome-scale protein structure determination and the issue of gene function identification become ever more pressing.
David T. Jones
openalex   +3 more sources

Protein Structure Prediction [PDF]

open access: yesBiophysical Journal, 2008
Protein structure prediction has matured over the past few years to the point that even fully automated methods can provide reasonably accurate three-dimensional models of protein structures. However, until now it has not been possible to develop programs able to perform as well as human experts, who are still capable of systematically producing better
AlLazikani B, Hill EE, Morea V
  +11 more sources

Deep template-based protein structure prediction.

open access: yesPLoS Computational Biology, 2021
MotivationProtein structure prediction has been greatly improved by deep learning, but most efforts are devoted to template-free modeling. But very few deep learning methods are developed for TBM (template-based modeling), a popular technique for protein
Fandi Wu, Jinbo Xu
doaj   +1 more source

Protein structure prediction [PDF]

open access: yesInternational Journal of Modern Physics B, 2018
Predicting 3D structure of protein from its amino acid sequence is one of the most important unsolved problems in biophysics and computational biology. This paper attempts to give a comprehensive introduction of the most recent effort and progress on protein structure prediction.
Haiyou, Deng, Ya, Jia, Yang, Zhang
openaire   +3 more sources

How long is a piece of loop? [PDF]

open access: yesPeerJ, 2013
Loops are irregular structures which connect two secondary structure elements in proteins. They often play important roles in function, including enzyme reactions and ligand binding. Despite their importance, their structure remains difficult to predict.
Yoonjoo Choi   +2 more
doaj   +2 more sources

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