Conformational Sampling of Bioactive Molecules: A Comparative Study

By D. Agrafiotis, A. Gibbs, Fangqiang Zhu, Sergei Izrailev, Eric J. Martin. 2007

89 citations recorded by the source corpus.

Subfields: Computational Theory and Mathematics, Molecular Biology, Computational Chemistry & Drug Discovery

How researchers see this paper

The researchers whose trusted networks rank it highest, strongest advocate first. Every researcher gets a different order.

In Computational Theory and Mathematics

1. Glaucius Oliva
2. L. Ferreira
3. Ricardo N Dos Santos
4. Adriano Defini Andricopulo
5. Luca Pinzi
6. Giulio Rastelli

In Molecular Biology

1. Glaucius Oliva
2. L. Ferreira
3. Ricardo N Dos Santos
4. Adriano Defini Andricopulo

In Computational Chemistry & Drug Discovery

1. Glaucius Oliva
2. Adriano Defini Andricopulo
3. L. Ferreira
4. Ricardo N Dos Santos
5. Giulio Rastelli
6. Luca Pinzi

Citations in the corpus

• Molecular Docking and Structure-Based Drug Design Strategies (2015, methodology): “Conformational search algorithms perform this task by applying systematic and stochastic search methods [25,26].”