Traian Sulea

According to our database, Traian Sulea authored at least 14 papers between 1997 and 2023.

Collaborative distances:

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

2023

Comparative Performance of High-Throughput Methods for Protein p<i>K</i>_a Predictions.

Wanlei Wei, Hervé Hogues, Traian Sulea

J. Chem. Inf. Model., August, 2023

2018

Binding pose and affinity prediction in the 2016 D3R Grand Challenge 2 using the Wilma-SIE method.

Hervé Hogues, Traian Sulea, Francis Gaudreault, Christopher R. Corbeil, Enrico O. Purisima

J. Comput. Aided Mol. Des., 2018

2016

Assessment of Solvated Interaction Energy Function for Ranking Antibody-Antigen Binding Affinities.

Traian Sulea, Victor Vivcharuk, Christopher R. Corbeil, Christophe Deprez, Enrico O. Purisima

J. Chem. Inf. Model., 2016

Evaluation of the Wilma-SIE Virtual Screening Method in Community Structure-Activity Resource 2013 and 2014 Blind Challenges.

Hervé Hogues, Traian Sulea, Enrico O. Purisima

J. Chem. Inf. Model., 2016

2014

Exhaustive docking and solvated interaction energy scoring: lessons learned from the SAMPL4 challenge.

Hervé Hogues, Traian Sulea, Enrico O. Purisima

J. Comput. Aided Mol. Des., 2014

2012

Predicting hydration free energies of polychlorinated aromatic compounds from the SAMPL-3 data set with FiSH and LIE models.

Traian Sulea, Enrico O. Purisima

J. Comput. Aided Mol. Des., 2012

Exhaustive search and solvated interaction energy (SIE) for virtual screening and affinity prediction.

Traian Sulea, Hervé Hogues, Enrico O. Purisima

J. Comput. Aided Mol. Des., 2012

2011

Solvated Interaction Energy (SIE) for Scoring Protein-Ligand Binding Affinities. 2. Benchmark in the CSAR-2010 Scoring Exercise.

Traian Sulea, Qizhi Cui, Enrico O. Purisima

J. Chem. Inf. Model., 2011

2010

Rapid prediction of solvation free energy. 3. Application to the SAMPL2 challenge.

Enrico O. Purisima, Christopher R. Corbeil, Traian Sulea

J. Comput. Aided Mol. Des., 2010

2007

Solvated Interaction Energy (SIE) for Scoring Protein-Ligand Binding Affinities, 1. Exploring the Parameter Space.

Marwen Naïm, Sathesh Bhat, Kathryn N. Rankin, Sheldon Dennis, Shafinaz F. Chowdhury, Imran Siddiqi, Piotr Drabik, Traian Sulea, Christopher I. Bayly, Araz Jakalian, Enrico O. Purisima

J. Chem. Inf. Model., 2007

2006

Coupled atomic charge selectivity for optimal ligand-charge distributions at protein binding sites.

Sathesh Bhat, Traian Sulea, Enrico O. Purisima

J. Comput. Chem., 2006

2003

On the transferability of hydration-parametrized continuum electrostatics models to solvated binding calculations.

Kathryn N. Rankin, Traian Sulea, Enrico O. Purisima

J. Comput. Chem., 2003

1998

MTD-ADJ: A multiconformational minimal topologic difference for determining bioactive conformers using adjusted biological activities.

Traian Sulea, Ludovic Kurunczi, Tudor I. Oprea, Zeno Simon

J. Comput. Aided Mol. Des., 1998

1997

A Different Method for Steric Field Evaluation in CoMFA Improves Model Robustness.

Traian Sulea, Tudor I. Oprea, Sorel Muresan, Shek Ling Chan

J. Chem. Inf. Comput. Sci., 1997