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Solvent and protein effects on the structure and dynamics of the rhodopsin chromophore

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Solvent and protein effects on the structure and dynamics of the rhodopsin chromophore

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From Sequence to Dynamics to Function: Computational Design of Allostery and Ligand Selectivity in G-Protein Coupled Receptors

Opportunities and challenges in design and optimization of protein function

Generative power of a protein language model trained on multiple sequence alignments

New protein–protein interactions designed by a computer

A Geometric Transformer for Structural Biology: Development and Applications of the Protein Structure Transformer

Towards automating de novo protein design for novel functionalities: controlling protein folds and protein-protein interactions

Computational design of novel protein–protein interactions – An overview on methodological approaches and applications

Assessment of transferable forcefields for protein simulations attests improved description of disordered states and secondary structure propensities, and hints at multi-protein systems as the next challenge for optimization

Method for generating variants of a protein

Method for generating variants of a protein

From Sequence to Dynamics to Function: Computational Design of Allostery and Ligand Selectivity in G-Protein Coupled Receptors

Generative power of a protein language model trained on multiple sequence alignments

Opportunities and challenges in design and optimization of protein function

Towards automating de novo protein design for novel functionalities: controlling protein folds and protein-protein interactions

A Geometric Transformer for Structural Biology: Development and Applications of the Protein Structure Transformer

Method for generating variants of a protein

Method for generating variants of a protein

New protein–protein interactions designed by a computer

Assessment of transferable forcefields for protein simulations attests improved description of disordered states and secondary structure propensities, and hints at multi-protein systems as the next challenge for optimization

Computational design of novel protein–protein interactions – An overview on methodological approaches and applications