Menthol carbonates as potent antiparasitic agents: synthesis and in vitro studies along with computer-aided approaches.
PMID:35698116
Electrostatic fingerprints of catalytically active amino acids in enzymes.
PMID:35481659
3DLigandSite: structure-based prediction of protein-ligand binding sites.
PMID:35412635
Protein cost minimization promotes the emergence of coenzyme redundancy.
PMID:35344442
Conformational Variation in Enzyme Catalysis: A Structural Study on Catalytic Residues.
PMID:35240125
Florigen and its homologs of FT/CETS/PEBP/RKIP/YbhB family may be the enzymes of small molecule metabolism: review of the evidence.
PMID:35086479
Worldwide Protein Data Bank (wwPDB): A virtual treasure for research in biotechnology.
PMID:34908533
A roadmap for metagenomic enzyme discovery.
PMID:34821235
Rhea, the reaction knowledgebase in 2022.
PMID:34755880
PDBe-KB: collaboratively defining the biological context of structural data.
PMID:34755867
Machine learning for enzyme engineering, selection and design.
PMID:34296736
Graph transformation for enzymatic mechanisms.
PMID:34252947
Machine learning differentiates enzymatic and non-enzymatic metals in proteins.
PMID:34140507
BENZ WS: the Bologna ENZyme Web Server for four-level EC number annotation.
PMID:33963861
Quantifying evolutionary importance of protein sites: A Tale of two measures.
PMID:33826605
Addressing uncertainty in genome-scale metabolic model reconstruction and analysis.
PMID:33602294
Water and Life: The Medium is the Message.
PMID:33427903
An automated protocol for modelling peptide substrates to proteases.
PMID:33375946
The impact of structural bioinformatics tools and resources on SARS-CoV-2 research and therapeutic strategies.
PMID:33348379
FireProtASR: A Web Server for Fully Automated Ancestral Sequence Reconstruction.
PMID:33346815
Real-time structural motif searching in proteins using an inverted index strategy.
PMID:33284792
CATH functional families predict functional sites in proteins.
PMID:33135053
A strategy for large-scale comparison of evolutionary- and reaction-based classifications of enzyme function.
PMID:32449511
The Hitchhiker's guide to biocatalysis: recent advances in the use of enzymes in organic synthesis.
PMID:32206264
Developing and applying computational resources for biochemistry education.
PMID:32203640
Autocatalytic chemical networks at the origin of metabolism.
PMID:32156207
A Benchmark for Homomeric Enzyme Active Site Structure Prediction Highlights the Importance of Accurate Modeling of Protein Symmetry.
PMID:31909318
A global analysis of function and conservation of catalytic residues in enzymes.
PMID:31796628
Environmental boundary conditions for the origin of life converge to an organo-sulfur metabolism.
PMID:31712697
MANET 3.0: Hierarchy and modularity in evolving metabolic networks.
PMID:31648227
Challenges in the annotation of pseudoenzymes in databases: the UniProtKB approach.
PMID:31618524
PDBe-KB: a community-driven resource for structural and functional annotations.
PMID:31584092
funtrp: identifying protein positions for variation driven functional tuning.
PMID:31584091
VarMap: a web tool for mapping genomic coordinates to protein sequence and structure and retrieving protein structural annotations.
PMID:31192369
Caver Web 1.0: identification of tunnels and channels in proteins and analysis of ligand transport.
PMID:31114897
Characterization of recombinant endo-1,4-β-xylanase of Bacillus halodurans C-125 and rational identification of hot spot amino acid residues responsible for enhancing thermostability by an in-silico approach.
PMID:31079316
PIRSitePredict for protein functional site prediction using position-specific rules.
PMID:30805646
CATH: expanding the horizons of structure-based functional annotations for genome sequences.
PMID:30398663
Updates in Rhea: SPARQLing biochemical reaction data.
PMID:30272209
Ranking Enzyme Structures in the PDB by Bound Ligand Similarity to Biological Substrates.
PMID:29551288
The 2018 Nucleic Acids Research database issue and the online molecular biology database collection.
PMID:29316735
The European Bioinformatics Institute in 2017: data coordination and integration.
PMID:29186510