|
🐢
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Probing the Environmental Toxicity of Deep Eutectic Solvents and Their Components: An In Silico Modeling Approach
A. Halder,
M. N. D. Cordeiro
|
6 |
2019 |
6
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|
|
🐢
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QSAR-Co: An Open Source Software for Developing Robust Multitasking or Multitarget Classification-Based QSAR Models
Pravin Ambure,
A. Halder,
Humberto González Díaz,
M. N. D. Cordeiro
|
6 |
2019 |
6
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🐢
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Multi-target drug discovery in anti-cancer therapy: fragment-based approach toward the design of potent and versatile anti-prostate cancer agents.
A. Speck-Planche,
V. V. Kleandrova,
F. Luan,
M. N. D. Cordeiro
|
5 |
2011 |
5
🐢
|
|
🐢
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De novo computational design of compounds virtually displaying potent antibacterial activity and desirable in vitro ADMET profiles
A. Speck-Planche,
M. N. D. Cordeiro
|
5 |
2017 |
5
🐢
|
|
🐢
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Desirability‐based multiobjective optimization for global QSAR studies: Application to the design of novel NSAIDs with improved analgesic, antiinflammatory, and ulcerogenic profiles
M. Cruz-Monteagudo,
Fernanda Borges,
M. N. D. Cordeiro
|
5 |
2008 |
5
🐢
|
|
🐢
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Fragment-based in silico modeling of multi-target inhibitors against breast cancer-related proteins
A. Speck-Planche,
M. N. D. Cordeiro
|
5 |
2017 |
5
🐢
|
|
🐬
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Computational chemistry approach for the early detection of drug‐induced idiosyncratic liver toxicity
M. Cruz-Monteagudo,
M. N. D. Cordeiro,
Fernanda Borges
|
5 |
2008 |
5
🐬
|
|
🐬
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Solvent Accessible Surface Area-Based Hot-Spot Detection Methods for Protein-Protein and Protein-Nucleic Acid Interfaces
C. Munteanu,
António C Pimenta,
C. Fernandez-Lozano,
A. Melo,
M. N. D. Cordeiro,
I. Moreira
|
5 |
2015 |
5
🐬
|
