Hosein Fooladi

Expert
@HFooladi

Machine Learning researcher. Deep learning for drug discovery. Finding bugs in intelligence. Interested in Artificial Life. @molinfo-vienna @ShenakhtPajouh

hfooladi.github.io/

GNNs-For-Chemists. Implementations of different GNNs from scratch for chemists

174

pdbrust. A Rust library for parsing PDB (Protein Data Bank) files

20

sdfrust. A fast, pure-Rust parser for SDF and MOL2 chemical structure files

8

ALineMol. Exploring performance of machine learning model on out-of-distribution data in chemical domain

7

THEMAP. Task Hardness Estimation for Molecular Activity Predcition (THEMAP)

4

Self_Organization. Mathematical Model For Self-Organization of Human Embryonic Stem Cells

3

Transformers-For-Chemists. Educational repo: building a tiny MolFormer-style encoder transformer from scratch for chemists. Sister course to GNNs-For-Chemists.

3

molax. Molecular active learning with JAX

1

awesome-phd-thesis. I am presenting the PhD thesis that I have found useful and interesting

1

HFooladi.github.io. A personal blog where I write my ideas and thoughts.

1

rustmolbpe. High-performance BPE tokenizer for molecular SMILES written in Rust with Python bindings

1

chembl-pdb-linker. Link ChEMBL bioactivity data with PDB structural information

1
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