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Modern drug design: the implication of using artificial neuronal networks and multiple molecular dynamic simulations
We report the implementation of molecular modeling approaches developed as a part of the 2016 Grand Challenge 2, the blinded competition of computer aided drug design technologies held by the D3R Drug Design Data Resource (https://drugdesigndata.org/). The challenge was focused on the ligands of the...
| Autores principales: | , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
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Springer International Publishing
2017
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| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5767208/ https://www.ncbi.nlm.nih.gov/pubmed/29134430 http://dx.doi.org/10.1007/s10822-017-0085-7 |