R.E.D. Server: a web service for deriving RESP and ESP charges and building force field libraries for new molecules and molecular fragments

por Vanquelef, Enguerran, Simon, Sabrina, Marquant, Gaelle, Garcia, Elodie, Klimerak, Geoffroy, Delepine, Jean Charles, Cieplak, Piotr, Dupradeau, François-Yves
Publicado 2011