Pinned Repositories
chemprop
Message Passing Neural Networks for Molecule Property Prediction
admet_ai
Training and prediction scripts for Chemprop models trained on ADMET datasets
chemfunc
Useful functions for working with small molecules
chemprop-factor
Matrix factorization and deep learning for molecular property prediction
chemprop-intro
An introduction to machine learning for chemical property prediction
escape_embeddings
Modeling SARS-CoV-2 antigen escape from antibodies using pretrained protein language model embeddings.
IntroML
A hands-on introduction to machine learning
p_tqdm
Parallel processing with progress bars
SyntheMol
Combinatorial antibiotic generation
typed-argument-parser
Typed argument parser for Python
swansonk14's Repositories
swansonk14/typed-argument-parser
Typed argument parser for Python
swansonk14/p_tqdm
Parallel processing with progress bars
swansonk14/SyntheMol
Combinatorial antibiotic generation
swansonk14/admet_ai
Training and prediction scripts for Chemprop models trained on ADMET datasets
swansonk14/chemfunc
Useful functions for working with small molecules
swansonk14/IntroML
A hands-on introduction to machine learning
swansonk14/chemprop-intro
An introduction to machine learning for chemical property prediction
swansonk14/chemprop-factor
Matrix factorization and deep learning for molecular property prediction
swansonk14/escape_embeddings
Modeling SARS-CoV-2 antigen escape from antibodies using pretrained protein language model embeddings.
swansonk14/MCTS_Interpretability
Monte Carlo Tree Search for Interpreting Stress Conditions in Natural Language
swansonk14/random_pairs
Randomly pairs people
swansonk14/graphing_fleas
A 2-dimensional Turing Machine simulator
swansonk14/icml18-jtnn
swansonk14/mcmc-decrypt
Markov Chain Monte Carlo for decryption
swansonk14/language_models_biology
swansonk14/PersonalWebsite
swansonk14/rapidcell
Multiscale modeling of E.coli chemotaxis
swansonk14/binding-ddg-predictor
open source repository
swansonk14/chemotaxis
swansonk14/clmtrackr
Javascript library for precise tracking of facial features via Constrained Local Models
swansonk14/dinov2
PyTorch code and models for the DINOv2 self-supervised learning method.
swansonk14/entry-cli
Command line app for predicting bacterial accumulation
swansonk14/gflownet
GFlowNet library specialized for graph & molecular data
swansonk14/gitsync
swansonk14/hgraph2graph
Hierarchical Generation of Molecular Graphs using Structural Motifs
swansonk14/mammo-keras
swansonk14/multiobj-rationale
Multi-Objective Molecule Generation using Interpretable Substructures (ICML 2020)
swansonk14/tcr-bert
Large language modeling applied to T-cell receptor (TCR) sequences.
swansonk14/test
swansonk14/tictactoe
A simple website for playing tic tac toe.