ricalessandri
commented
1 year ago The development of PR https://github.com/ricalessandri/Martini3-small-molecules/pull/14 will shape this procedure.
Open ricalessandri opened 1 year ago
ricalessandri
commented
1 year ago The development of PR https://github.com/ricalessandri/Martini3-small-molecules/pull/14 will shape this procedure.
What is the list of files needed? These 8 files.
What is the minimal validation required? Probably logP and density.