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Protein Folding

Papers

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Showing 126–150 of 185 papers

TitleStatusHype
Two for One: Diffusion Models and Force Fields for Coarse-Grained Molecular Dynamics—0
Two-phase protein folding optimization on a three-dimensional AB off-lattice model—0
Understanding the Capabilities of Large Language Models for Automated Planning—0
Unsupervised and Supervised Structure Learning for Protein Contact Prediction—0
Using Residual Dipolar Couplings from Two Alignment Media to Detect Structural Homology—0
Validation of an LLM-based Multi-Agent Framework for Protein Engineering in Dry Lab and Wet Lab—0
Variational embedding of protein folding simulations using gaussian mixture variational autoencoders—0
Variational Quantum Algorithms for Chemical Simulation and Drug Discovery—0
A 23 MW data centre is all you need—0
Weighted persistent homology for osmolyte molecular aggregation and hydrogen-bonding network analysis—0
AbODE: Ab Initio Antibody Design using Conjoined ODEs—0
Accelerated Sampling of Rare Events using a Neural Network Bias Potential—0
Coupling streaming AI and HPC ensembles to achieve 100-1000x faster biomolecular simulations—0
Adaptive Markov State Model estimation using short reseeding trajectories—0
A glass-box interactive machine learning approach for solving NP-hard problems with the human-in-the-loop—0
A maximum-caliber approach to predicting perturbed folding kinetics due to mutations—0
A method for partitioning the information contained in a protein sequence between its structure and function—0
Analysis and prediction of protein folding energy changes upon mutation by element specific persistent homology—0
Analysis of proteins in the light of mutations—0
Analyzing the Performance of Graph Neural Networks with Pipe Parallelism—0
An Evaluation of Real-time Adaptive Sampling Change Point Detection Algorithm using KCUSUM—0
A Novel P-bit-based Probabilistic Computing Approach for Solving the 3-D Protein Folding Problem—0
A Tale of Two Desolvation Potentials: An Investigation of Protein Behavior Under High Hydrostatic Pressure—0
A topological study of protein folding kinetics—0
Bloch spin waves and emergent structure in protein folding with HIV envelope glycoprotein as an example—0
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