Topic: retrosynthesis Goto Github
Some thing interesting about retrosynthesis
Some thing interesting about retrosynthesis
retrosynthesis,AIChemist ζΊθ½εε¦
User: bruceunx
Home Page: https://aichem.pylogic.net/
retrosynthesis,modify original aizynthfinder code for end-user
User: bruceunx
retrosynthesis,modify from askcos context recommendition
User: bruceunx
retrosynthesis,Energy-based modeling of chemical reactions
Organization: coleygroup
retrosynthesis,A command-line tool for simple, single-step retrosynthetic reaction prediction using graph partitioning.
User: davidjtoomer
retrosynthesis,RetroBridge: Markov Bridge Model for Retrosynthesis Planning
User: igashov
retrosynthesis,Retrosynthesis prediction for organic molecules with LocalRetro
Organization: kaist-amsg
retrosynthesis,Twitter retrosynthesis bot
User: n-yoshikawa
Home Page: https://twitter.com/retrosynthchan
retrosynthesis,The NeoChemSynthWave: Chemistry project.
Organization: neo-chem-synth-wave
Home Page: https://github.com/neo-chem-synth-wave
retrosynthesis,A repository for evaluating single-step retrosynthesis algorithms
Organization: optimal-pse-lab
retrosynthesis,Supporting code for the "Autonomous retrosynthesis of gold nanoparticles via spectral shape matching" paper. DOI : 10.1039/D2DD00025C
Organization: pozzo-research-group
retrosynthesis,A web application to display the retrosynthetic reaction pathway using FLASK
User: quicklearner171998
retrosynthesis,Source code and documentation of a computer assisted synthesis planning (CASP) tool used for the analysis of reaction datasets.
Organization: reymond-group
retrosynthesis,Multi-Step Retrosynthesis Tool based on Augmented Disconnection Aware Triple Transformer Loop Predictions
Organization: reymond-group
retrosynthesis,Preprocessing of datasets of chemical reactions: standardization, filtering, augmentation, tokenization, etc.
Organization: rxn4chemistry
Home Page: https://rxn4chemistry.github.io/rxn-reaction-preprocessing/
retrosynthesis,Learning Graph Models for Retrosynthesis Prediction (NeurIPS 2021)
User: vsomnath
Home Page: https://arxiv.org/abs/2006.07038
retrosynthesis,RetroExplainer: A chemical knowledge and deep-leaning guided molecular assembly approach for retrosynthesis prediction with quantitative interpretability
User: wangyu-sd
retrosynthesis,Asynchronous chemoenzymatic retrosynthesis
Organization: zhao-group
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