Abstract: Techniques for predicting a pair of an enzyme primary sequence and a substrate, and interaction probability for the pair are described. An exemplary method includes receiving a request to predict a pair of an enzyme primary sequence and a substrate, and interaction probability for the pair; combining an enzyme vector, a substrate vector, and an interaction indication for the enzyme and substrate to form a machine learning model input; applying a machine learning model to the machine learning model input to predict the pair of an enzyme primary sequence and a substrate, and interaction probability for the pair; and outputting a result of the application of the machine learning model including the predicted pair of an enzyme primary sequence and a substrate, and interaction probability for the pair.

Abstract: Techniques for predicting a protein sequence are described. An exemplary method includes receiving a request to predict a missing area of a protein's primary sequence and a corresponding three-dimensional position of the missing area; applying a machine learning model to backbone Cartesian coordinates of the protein's primary sequence and a protein vector of a representation of the protein's primary sequence including the missing area to predict a missing area of the protein primary sequence and a corresponding three-dimensional position for the missing area, wherein the machine learning model is selected from the group consisting of: an attention-based machine learning model, a bidirectional long short term memory-based model, and a convolutional neural network-based model; and outputting a result of the machine learning model.