Kangway V Chuang

发表

Adversarial Controls for Scientific Machine Learning.

Michael J. Keiser, Kangway V. Chuang, Kangway V Chuang, 2018, ACS chemical biology.

Comment on “Predicting reaction performance in C–N cross-coupling using machine learning”

Michael J. Keiser, Kangway V. Chuang, Kangway V Chuang, 2018, Science.

Learning Molecular Representations for Medicinal Chemistry.

Michael J. Keiser, Kangway V. Chuang, Kangway V Chuang, 2020, Journal of medicinal chemistry.

A 15-step synthesis of (+)-ryanodol

Kangway V. Chuang, Kangway V Chuang, S. Reisman, 2016, Science.

A Copper-Catalyzed Arylation of Tryptamines for the Direct Synthesis of Aryl Pyrroloindolines.

Kangway V. Chuang, Kangway V Chuang, S. Reisman, 2012, Chemical science.

A 3D-Shape Similarity-based Contrastive Approach to Molecular Representation Learning

Kangway V. Chuang, Kangway V Chuang, Gabriele Scalia, 2022, ArXiv.

Interpretable classification of Alzheimer’s disease pathologies with a convolutional neural network pipeline

Michael J. Keiser, Brittany N. Dugger, Ziqi Tang, 2018, Nature Communications.

Copper-catalyzed diastereoselective arylation of tryptophan derivatives: total synthesis of (+)-naseseazines A and B.

Kangway V. Chuang, Kangway V Chuang, S. Reisman, 2013, Journal of the American Chemical Society.

Short, enantioselective total syntheses of (-)-8-demethoxyrunanine and (-)-cepharatines A, C, and D.

Kangway V. Chuang, Kangway V Chuang, S. Reisman, 2011, Angewandte Chemie.

Benzoquinone-derived sulfinyl imines as versatile intermediates for alkaloid synthesis: Total synthesis of (–)-3-demethoxyerythratidinone

Kangway V. Chuang, Kangway V Chuang, S. Reisman, 2011 .

A Mild and General Larock Indolization Protocol for the Preparation of Unnatural Tryptophans.

Kangway V. Chuang, Kangway V Chuang, S. Reisman, 2016, Organic letters.

CREMP: Conformer-Rotamer Ensembles of Macrocyclic Peptides for Machine Learning

Colin A. Grambow, Kangway V. Chuang, Kangway V Chuang, 2023, ArXiv.

RINGER: Rapid Conformer Generation for Macrocycles with Sequence-Conditioned Internal Coordinate Diffusion

Colin A. Grambow, Kangway V. Chuang, Kangway V Chuang, 2023, ArXiv.

Accurate and Efficient Structural Ensemble Generation of Macrocyclic Peptides using Internal Coordinate Diffusion

Colin A. Grambow, Kangway V Chuang, Gabriele Scalia, 2023, 2305.19800.