Michael E. Fortunato

According to our database, Michael E. Fortunato authored at least 5 papers between 2017 and 2022.

Collaborative distances:

• Dijkstra number of five.
• Erdős number of four.

2022

Predicting In Vivo Compound Brain Penetration Using Multi-task Graph Neural Networks.

Seid Hamzic, Richard A. Lewis, Sandrine Desrayaud, Cihan Soylu, Mike Fortunato, Grégori Gerebtzoff, Raquel Rodríguez-Pérez

J. Chem. Inf. Model., 2022

2021

Update 1.1 to "pysimm: A python package for simulation of molecular systems", (PII: S2352711016300395).

Alexander G. Demidov, B. Lakshitha A. Perera, Michael E. Fortunato, Sibo Lin, Coray M. Colina

SoftwareX, 2021

2020

Data Augmentation and Pretraining for Template-Based Retrosynthetic Prediction in Computer-Aided Synthesis Planning.

Michael E. Fortunato, Connor W. Coley, Brian C. Barnes, Klavs F. Jensen

J. Chem. Inf. Model., 2020

2018

Update 0.2 to "pysimm: A python package for simulation of molecular systems".

Alexander G. Demidov, Michael E. Fortunato, Coray M. Colina

SoftwareX, 2018

2017

pysimm: A python package for simulation of molecular systems.

Michael E. Fortunato, Coray M. Colina

SoftwareX, 2017