New (GRO A4) projects 14049

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New (GRO A4) projects 14049

Postby yunhui » Mon Mar 19, 2018 1:13 pm

Releasing new SMP A4 (GRO_A4) projects p14049 to FAH.
These are simulations of four different ligands designed as MDM2 inhibitors. This work aims to provide us binding mode of these ligands for MDM2 which is an important system in cancer therapeutics. This project is a minor modification of p13784.
A full description of these projects is here

Projects: 14049
stats credit: 1211
timeout: 18.5
deadline 40.5
k-factor v=0.75
number of atoms: 37069
Posts: 134
Joined: Mon May 16, 2016 3:24 pm

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