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50_layer_resnet

50 Layer Resnet to predict the regression values of Tetrahymena pyriformis IGC50 from 2d molecular images only

ai_clinician

Reinforcement learning for medical decisions

aitextgen

A robust Python tool for text-based AI training and generation using GPT-2.

alali

Automated Loading assuming Atomic Level Interactions (ALALI): A python tool to map atoms to qubits, including IBM Q topologies. GPL-3.0-or-later.

algorithms-for-dna-sequencing

Codes from Coursera's course Algorithms for DNA sequencing, part of genomic data science specialization offered by Johns Hopkins University

augmented-gcn

awesome-cheminformatics

A curated list of awesome Cheminformatics libraries and software.

awesome-marketing-datascience

Curated list of useful LLM / Analytics / Datascience resources

bayeslabs.github.io

Blog that explains our research work.

biopython.github.io

Source of biopython.org website, migrated from MediaWiki

cardiotox

chemception

CNN model based on Google Inception model to predict regression values of regression values of Tetrahymena pyriformis IGC50 from 2D images of molcules

chemicalxabdul

A PyTorch and TorchDrug based deep learning library for drug pair scoring.

deep-reinforcement-learning-dqn

Deep Reinforcement Learning with DQN, Double DQN, Dueling DQN, Noisy Net (Noisy DQN), and DQN with Prioritized Experience Replay

deep-reinforcement-learning-hands-on

Hands-on Deep Reinforcement Learning, published by Packt

deepchem

Democratizing Deep-Learning for Drug Discovery, Quantum Chemistry, Materials Science and Biology

deepinsight

A methodology to transform a non-image data to an image for convolution neural network architecture

deeplearninglifesciences

Example code from the book "Deep Learning for the Life Sciences"

deepsmiles

DeepSMILES - A variant of SMILES for use in machine-learning

deepsynergy

drlx

Diffusion Reinforcement Learning Library

drug-synergy-modeling

Machine learning analysis for prediction of synergistic drug behavior

etoxpred

fill

Generative fill in 3D.

flair

A very simple framework for state-of-the-art Natural Language Processing (NLP)

fp2vec

gentrl

Generative Tensorial Reinforcement Learning (GENTRL) model

gpt-3

GPT-3: Language Models are Few-Shot Learners

gpt4-pdf-chatbot-langchain

GPT4 & LangChain Chatbot for large PDF docs

graphinvent

Graph neural networks for molecular design.