The causes of evolvability and their evolution

JL Payne, A Wagner - Nature Reviews Genetics, 2019 - nature.com
Evolvability is the ability of a biological system to produce phenotypic variation that is both
heritable and adaptive. It has long been the subject of anecdotal observations and …

Using genome-scale models to predict biological capabilities

EJ O'Brien, JM Monk, BO Palsson - Cell, 2015 - cell.com
Constraint-based reconstruction and analysis (COBRA) methods at the genome scale have
been under development since the first whole-genome sequences appeared in the mid …

Deep learning-based kcat prediction enables improved enzyme-constrained model reconstruction

F Li, L Yuan, H Lu, G Li, Y Chen, MKM Engqvist… - Nature Catalysis, 2022 - nature.com
Enzyme turnover numbers (k cat) are key to understanding cellular metabolism, proteome
allocation and physiological diversity, but experimentally measured k cat data are sparse …

Fast automated reconstruction of genome-scale metabolic models for microbial species and communities

D Machado, S Andrejev, M Tramontano… - Nucleic acids …, 2018 - academic.oup.com
Genome-scale metabolic models are instrumental in uncovering operating principles of
cellular metabolism, for model-guided re-engineering, and unraveling cross-feeding in …

iML1515, a knowledgebase that computes Escherichia coli traits

JM Monk, CJ Lloyd, E Brunk, N Mih, A Sastry… - Nature …, 2017 - nature.com
Figure 1 iML1515 genome-scale reconstruction.(a) The iML1515 model contains 1,515
open reading frames that encode enzymes that catalyze 2,719 reactions involving 1,192 …

Antibiotic-resistant bacteria show widespread collateral sensitivity to antimicrobial peptides

V Lázár, A Martins, R Spohn, L Daruka, G Grézal… - Nature …, 2018 - nature.com
Antimicrobial peptides are promising alternative antimicrobial agents. However, little is
known about whether resistance to small-molecule antibiotics leads to cross-resistance …

Mixed quantum mechanical/molecular mechanical molecular dynamics simulations of biological systems in ground and electronically excited states

E Brunk, U Rothlisberger - Chemical reviews, 2015 - ACS Publications
The quantum nature of electrons and nuclei is manifested in countless biological events
including the rearrangements of electrons in biochemical reactions, electron and proton …

Integrated evolutionary analysis reveals antimicrobial peptides with limited resistance

R Spohn, L Daruka, V Lázár, A Martins… - Nature …, 2019 - nature.com
Antimicrobial peptides (AMPs) are promising antimicrobials, however, the potential of
bacterial resistance is a major concern. Here we systematically study the evolution of …

Networks and graphs discovery in metabolomics data analysis and interpretation

A Amara, C Frainay, F Jourdan, T Naake… - Frontiers in Molecular …, 2022 - frontiersin.org
Both targeted and untargeted mass spectrometry-based metabolomics approaches are used
to understand the metabolic processes taking place in various organisms, from prokaryotes …

Ultrahigh-throughput discovery of promiscuous enzymes by picodroplet functional metagenomics

PY Colin, B Kintses, F Gielen, CM Miton… - Nature …, 2015 - nature.com
Unculturable bacterial communities provide a rich source of biocatalysts, but their
experimental discovery by functional metagenomics is difficult, because the odds are …