iwatobipen Goto Github PK
Name: Taka
Type: User
Company: Daiichi-Sankyo
Bio: I'm Medicinal Chemist a/o Chemoinformatitian in mid. size pharmaceutical company in Japan. My hobby is programming, running and Volleyball.
Twitter: iwatobipen
Taka's Projects
3dfp
align-it-ob3
awesome-readme
A curated list of awesome READMEs
bindingdb
Process BindingDB
bioinformatics-analysis-of-e3-ubiquitin-ligase-family
cats2d
rdkit_cats2d
chem_streamlit
chem_viz
chembl_multitask_model
Target prediction multitask neural network, with examples running it in Python, C++, Julia and JS
chembl_targetprediction
chemo_dash
chemo_info
chemo_skorch
chemobinder
cmappy
Assorted tools for interacting with .gct, .gctx files and other Connectivity Map (Broad Institute) data/tools
deeplearning
diffdock
Implementation of DiffDock: Diffusion Steps, Twists, and Turns for Molecular Docking
docker4chmoinfo
docstream_demo
electron_app_rdkit
entry-cli
Command line app for predicting bacterial accumulation
esp_dnn
A Graph-Convolutional Deep Neural Network for predicting electrostatic potential surfaces
fragfp
fragit-main
FragIt main repository
fragmenter
Fragment molecules for quantum mechanics torsion scans
github-slideshow
A robot powered training repository :robot:
gnnimplicitsolvent
Implicit Solvent Approach Based on Generalised Born and Transferable Graph Neural Networks for Molecular Dynamics Simulations
hitl_chem
is_life_worth_living-
iwatobipen
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