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Computational Understanding of Biocatalytic Evolution to Extreme Environments

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Publications

New paper out: Towards Rational Computational Engineering of Psychrophilic Enzymes
19 Dec 2019

New paper out: Towards Rational Computational Engineering of Psychrophilic Enzymes

by gvi022 | posted in: Publications | 0

Towards Rational Computational Engineering of Psychrophilic Enzymes Cold-adapted enzymes from psychrophilic species achieve their high catalytic efficiency at low temperature by a different partitioning of the activation free energy into its enthalpic and entropic components, compared to orthologous mesophilic enzymes. … Continued

QresFEP: an automated protocol for the free energy calculation of protein mutations in Q
27 Aug 2019

QresFEP: an automated protocol for the free energy calculation of protein mutations in Q

by gvi022 | posted in: Publications | 0

Abstract Predicting the effect of single-point mutations on protein stability or protein-ligand binding is a major challenge in computational biology. Free energy calculations constitute the most rigorous approach to this problem, though the estimation of converged values for amino acid … Continued

Qgui
New paper out: Catalytic Adaptation of Psychrophilic Elastase
14 May 2018

New paper out: Catalytic Adaptation of Psychrophilic Elastase

by gvi022 | posted in: Publications | 0

Catalytic Adaptation of Psychrophilic Elastase The class I pancreatic elastase from Atlantic salmon is considered to be a cold-adapted enzyme in view of the cold habitat, the reduced thermostability of the enzyme, and the fact that it is faster than its mesophilic porcine … Continued

cold adaptation, elastase, publication

Recent Posts

  • New paper out: Towards Rational Computational Engineering of Psychrophilic Enzymes
  • New CUBE3 doctoral fellow: Ryan Wilkins
  • Article about Tromsø VR lab at Forskningsdagene.no
  • QresFEP: an automated protocol for the free energy calculation of protein mutations in Q
  • Tromsø VR lab in the making

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