Jérôme Hert

According to our database, Jérôme Hert authored at least 8 papers between 2004 and 2021.

Collaborative distances:

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

2021

The Playbooks of Medicinal Chemistry Design Moves.

Mahendra Awale, Jérôme Hert, Laura Guasch, Sereina Riniker, Christian Kramer

J. Chem. Inf. Model., 2021

2018

mmpdb: An Open-Source Matched Molecular Pair Platform for Large Multiproperty Data Sets.

Andrew Dalke, Jérôme Hert, Christian Kramer

J. Chem. Inf. Model., 2018

2016

Torsion Library Reloaded: A New Version of Expert-Derived SMARTS Rules for Assessing Conformations of Small Molecules.

Wolfgang Guba, Agnes Meyder, Matthias Rarey, Jérôme Hert

J. Chem. Inf. Model., 2016

2009

Turbo similarity searching: Effect of fingerprint and dataset on virtual-screening performance.

Eleanor J. Gardiner, Valerie J. Gillet, Maciej Haranczyk, Jérôme Hert, John D. Holliday, Nurul Malim, Yogendra Patel, Peter Willett

Stat. Anal. Data Min., 2009

Enhancing the Effectiveness of Fingerprint-Based Virtual Screening: Use of Turbo Similarity Searching and of Fragment Frequencies of Occurrence.

Shereena M. Arif, Jérôme Hert, John D. Holliday, Nurul Malim, Peter Willett

Proceedings of the Pattern Recognition in Bioinformatics, 2009

2008

Quantifying the Relationships among Drug Classes.

Jérôme Hert, Michael J. Keiser, John J. Irwin, Tudor I. Oprea, Brian K. Shoichet

J. Chem. Inf. Model., 2008

2006

New Methods for Ligand-Based Virtual Screening: Use of Data Fusion and Machine Learning to Enhance the Effectiveness of Similarity Searching.

Jérôme Hert, Peter Willett, David J. Wilton, Pierre Acklin, Kamal Azzaoui, Edgar Jacoby, Ansgar Schuffenhauer

J. Chem. Inf. Model., 2006

2004

Comparison of Fingerprint-Based Methods for Virtual Screening Using Multiple Bioactive Reference Structures.

Jérôme Hert, Peter Willett, David J. Wilton, Pierre Acklin, Kamal Azzaoui, Edgar Jacoby, Ansgar Schuffenhauer

J. Chem. Inf. Model., 2004