Docking rigid macrocycles using Convex-PL, AutoDock Vina, and RDKit in the D3R Grand Challenge 4
Crossref DOI link: https://doi.org/10.1007/s10822-019-00263-3
Published Online: 2019-11-29
Published Print: 2020-02
Update policy: https://doi.org/10.1007/springer_crossmark_policy
Kadukova, Maria
Chupin, Vladimir
Grudinin, Sergei http://orcid.org/0000-0002-1903-7220
Funding for this research was provided by:
Ministry of Education and Science of the Russian Federation (6.3157.2017)
Text and Data Mining valid from 2019-11-29
Version of Record valid from 2019-11-29
Article History
Received: 14 June 2019
Accepted: 22 November 2019
First Online: 29 November 2019