Paulo J Costa

19PUBLICATIONS
36CO-AUTHORS
Computational chemistryBiomolecular modelling and designMain group metal chemistryOrganometallic chemistryChemical thermodynamics and energetics
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Publications (19)

|May 14, 2026
Conformer Generation Workflows for COSMO-RS Calculations: Are They All the Same?

|Mar 24, 2026
Impact of the halogen PB radii in the estimation of protein-ligand binding energies using MM-PBSA calculations.

Andreia Fortuna, Paulo J Costa

|May 25, 2024
Synthesis, Activity, Toxicity, and In Silico Studies of New Antimycobacterial N-Alkyl Nitrobenzamides.

João P Pais, Olha Antoniuk, David Pires

|Mar 19, 2024
Exploiting Co(III)-Cyclopentadienyl Complexes To Develop Anticancer Agents.

João Franco Machado, Sandra Cordeiro, Joana N Duarte

|Feb 24, 2024
Paraptotic Cell Death as an Unprecedented Mode of Action Observed for New Bipyridine-Silver(I) Compounds Bearing Phosphane Coligands.

Ricardo G Teixeira, Alessia Stefanelli, Adhan Pilon

|Nov 27, 2023
Assessment of Halogen Off-Center Point-Charge Models Using Explicit Solvent Simulations.

Andreia Fortuna, Paulo J Costa

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Frequent Collaborators

5 joint publications

Rafael Santana Nunes

3 joint publications

Diogo Vila-Viçosa

3 joint publications

Andreia Fortuna

2 joint publications

M Conceição Oliveira