Add to ORKGArtificial chemistries can be used to explore the generic properties of chemical reaction networks. In order to simulate for instance scenarios of prebiotic evolution the model must be close enough to real chemistry to allow at least semi-quantitative comparisons. One example is a previously described Toy Model that represents molecules as graphs, thereby neglecting 3D space, and employs a highly simplified version of the Extended H¨uckel Theory (EHT) to compute molecular properties. Here we show how the Toy Model can be extended to multiple phases by connecting the EHT calculations with chemical thermodynamics
This chapter discusses the fundamental ideas of how chemical networks are build, their strengths and...
Polymers of hydrogen cyanide and their hydrolysis products constitute a plausible, but still poorly ...
Until very recently, synthetic chemistry has focussed on the creation of chemical entities with desi...
Artificial chemistries can be used to explore the generic properties of chemical reaction networks. ...
Large scale chemical reaction networks are a ubiquitous phenomenon, from the metabolism of living ce...
A Toy Model of an artificial chemistry that treats molecules as graphs was implemented based on a si...
We use a Toy Model of chemistry that represents molecules in terms of usual structural formulae to g...
Computational techniques are required for narrowing down the vast space of possibilities to plausibl...
A core topic of research in prebiotic chemistry is the search for plausible synthetic routes that co...
The chemical universe of molecules reachable from a set of start compounds by iterative application ...
Metabolism can be regarded as a network of biochemical reactions, connected via their substrates and...
The study of complex mixtures of interacting synthetic molecules has historically not received much ...
For the modelling of chemistry we use undirected, labelled graphs as explicit models of molecules an...
Polymers of hydrogen cyanide and their hydrolysis products constitute a plausible, but still poorly ...
Every living cell is a tiny, intricate chemical computer. But what aspects of chemistry can create t...
This chapter discusses the fundamental ideas of how chemical networks are build, their strengths and...
Polymers of hydrogen cyanide and their hydrolysis products constitute a plausible, but still poorly ...
Until very recently, synthetic chemistry has focussed on the creation of chemical entities with desi...
Artificial chemistries can be used to explore the generic properties of chemical reaction networks. ...
Large scale chemical reaction networks are a ubiquitous phenomenon, from the metabolism of living ce...
A Toy Model of an artificial chemistry that treats molecules as graphs was implemented based on a si...
We use a Toy Model of chemistry that represents molecules in terms of usual structural formulae to g...
Computational techniques are required for narrowing down the vast space of possibilities to plausibl...
A core topic of research in prebiotic chemistry is the search for plausible synthetic routes that co...
The chemical universe of molecules reachable from a set of start compounds by iterative application ...
Metabolism can be regarded as a network of biochemical reactions, connected via their substrates and...
The study of complex mixtures of interacting synthetic molecules has historically not received much ...
For the modelling of chemistry we use undirected, labelled graphs as explicit models of molecules an...
Polymers of hydrogen cyanide and their hydrolysis products constitute a plausible, but still poorly ...
Every living cell is a tiny, intricate chemical computer. But what aspects of chemistry can create t...
This chapter discusses the fundamental ideas of how chemical networks are build, their strengths and...
Polymers of hydrogen cyanide and their hydrolysis products constitute a plausible, but still poorly ...
Until very recently, synthetic chemistry has focussed on the creation of chemical entities with desi...
