Druggable exosites of the human kino-pocketome George NicolaIrina KufarevaRuben Abagyan OriginalPaper 10 January 2020 Pages: 219 - 230
Conformational analysis of macrocycles: comparing general and specialized methods Gustav OlandersHiba AlogheliAnders Karlén OriginalPaper Open access 21 January 2020 Pages: 231 - 252
Atomistic insight into sequence-directed DNA bending and minicircle formation propensity in the absence and presence of phased A-tracts Alberto MillsFederico Gago OriginalPaper 16 January 2020 Pages: 253 - 265
Software to obtain spatially localized functions from different radial functions Jesús Sánchez-MárquezVictor GarcíaManuel Fernández Original Research Article 02 January 2020 Pages: 267 - 280
A noncanonical binding site of linezolid revealed via molecular dynamics simulations G. I. MakarovT. M. Makarova OriginalPaper 12 December 2019 Pages: 281 - 291
Dissecting the molecular recognition of dual lapatinib derivatives for EGFR/HER2 Martiniano BelloConcepción Guadarrama-GarcíaRolando Alberto Rodriguez-Fonseca OriginalPaper 11 December 2019 Pages: 293 - 303
Influence of feature rankers in the construction of molecular activity prediction models Gonzalo Cerruela-GarcíaJosé Pérez-Parra ToledanoNicolás García-Pedrajas OriginalPaper 31 December 2019 Pages: 305 - 325