Gypsum-DL: an open-source program for preparing small-molecule libraries for structure-based virtual screening.
Patrick J. RoppJacob O. SpiegelJennifer L. WalkerHarrison GreenGuillermo A. MoralesKatherine A. MillikenJohn J. RingeJacob D. DurrantPublished in: J. Cheminformatics (2019)