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Lista de obras de Conrad Stork

ALADDIN: Docking Approach Augmented by Machine Learning for Protein Structure Selection Yields Superior Virtual Screening Performance

scientific article published on 08 November 2019

Computational Applications in Secondary Metabolite Discovery (CAiSMD): an online workshop

artículo científico publicado en 2021

FAME 2: Simple and Effective Machine Learning Model of Cytochrome P450 Regioselectivity

artículo científico publicado en 2017

FAME 3: Predicting the Sites of Metabolism in Synthetic Compounds and Natural Products for Phase 1 and Phase 2 Metabolic Enzymes

artículo científico publicado en 2019

GLORY: Generator of the Structures of Likely Cytochrome P450 Metabolites Based on Predicted Sites of Metabolism

artículo científico publicado en 2019

Hit Dexter 2.0: Machine-Learning Models for the Prediction of Frequent Hitters

article

Hit Dexter: A Machine-learning Model for the Prediction of Frequent Hitters.

artículo científico publicado en 2017

NP-Scout: Machine Learning Approach for the Quantification and Visualization of the Natural Product-Likeness of Small Molecules

artículo científico publicado en 2019

PAIN(S) relievers for medicinal chemists: how computational methods can assist in hit evaluation

artículo científico publicado en 2018

Skin Doctor CP: Conformal Prediction of the Skin Sensitization Potential of Small Organic Molecules

scientific article published on 09 December 2020

Why Are Dithienylethene-Linked Biscobaltocenes so Hard to Photoswitch?

artículo científico publicado en 2017

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