Designing microbial cell factories for the production of chemicals

JS Cho, GB Kim, H Eun, CW Moon, SY Lee - Jacs Au, 2022 - ACS Publications
The sustainable production of chemicals from renewable, nonedible biomass has emerged
as an essential alternative to address pressing environmental issues arising from our heavy …

Ascorbic acid-a potential oxidant scavenger and its role in plant development and abiotic stress tolerance

NA Akram, F Shafiq, M Ashraf - Frontiers in plant science, 2017 - frontiersin.org
Over-production of reactive oxygen species (ROS) in plants under stress conditions is a
common phenomenon. Plants tend to counter this problem through their ability to synthesize …

Enzyme function prediction using contrastive learning

T Yu, H Cui, JC Li, Y Luo, G Jiang, H Zhao - Science, 2023 - science.org
Enzyme function annotation is a fundamental challenge, and numerous computational tools
have been developed. However, most of these tools cannot accurately predict functional …

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 …

A map of protein-metabolite interactions reveals principles of chemical communication

I Piazza, K Kochanowski, V Cappelletti, T Fuhrer… - Cell, 2018 - cell.com
Metabolite-protein interactions control a variety of cellular processes, thereby playing a
major role in maintaining cellular homeostasis. Metabolites comprise the largest fraction of …

Recent advances and challenges in the biotechnological upcycling of plastic wastes for constructing a circular bioeconomy

S Lee, YR Lee, SJ Kim, JS Lee, K Min - Chemical Engineering Journal, 2023 - Elsevier
Plastics are commonly used in daily life and various industries, generating massive
quantities of plastic wastes and causing severe environmental concerns. Thus, the upcycling …

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 …

Constraint-based models predict metabolic and associated cellular functions

A Bordbar, JM Monk, ZA King, BO Palsson - Nature Reviews Genetics, 2014 - nature.com
The prediction of cellular function from a genotype is a fundamental goal in biology. For
metabolism, constraint-based modelling methods systematize biochemical, genetic and …

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 …