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3d_scaffold

3D-Scaffold Generator

aa_vae

Amino-acid Variational Autoencoder

awesome-mlss

List of summer schools in machine learning + related fields across the globe

beta-lactamase

bk_clustering

Burj Khalifa Clustering method

chem_tutorial

chembiomultimodalautoencoders

a package for streamlined multidomain data integration and translation based on cross-modal autoencoders architectures

chemoinformatics-tutos

Compilation of chemoinformatics and machine learning techniques

codon-conservation-rate

Calculating codon and codon pair conservation rates across species of a given genus

cvapipe_analysis

Analysis of data produced by cvapipe for the variance paper

data_analytics

datasharing

The Leek group guide to data sharing

deploying-machine-learning-models

Code for the online course "Deployment of Machine Learning Models"

discrete_math_2

discrete_mathematics

Notes and Assignments for Discrete Mathematics I

dockstring

A Python package for molecular docking with an extensive, highly-curated dataset and a set of realistic benchmark tasks for drug discovery.

evodiff

Generation of protein sequences and evolutionary alignments via discrete diffusion models

frogs

Functional Embedding of Gene Signatures

functime

Time-series machine learning and embeddings at scale.

graph_convolutional_nn_molecule_maker

A Graph Neural Network (Geometric machine learning) for molecular generation

graphpruning

Package for "pruning" weighted complex networks based on the Marginal Likelihood Filter.

ice_breaker

intelligent_systems

Codes for Intelligent Systems

isglobal_2023

Python Implementation of the R Codes in the Summer School

langchain

⚡ Building applications with LLMs through composability ⚡

langchain_projects

Personal Projects in LLM Applications using LangChain and Pinecone.

linear_algebra

Discrete III

llm-finetuning-scripts

mbt_gym

mbt_gym is a module which provides a suite of gym environments for training reinforcement learning (RL) agents to solve model-based high-frequency trading problems such as market-making and optimal execution. The module is set up in an extensible way to allow the combination of different aspects of different models. It supports highly efficient imp

mentsea-chatbot

Mentsea is a friendly mental health chatbot for Southeast Asian Countries.