From: Jun Zhang (coolrainbow_at_yahoo.cn)
Date: Tue Mar 01 2011 - 08:24:59 CST
Hello everyone:
It seems that in NAMD2.7 the FEP calculation cannot be performed on GPU device. Does anyone know what technical reasons have constrained FEP calculation only on CPU. Thank you in advance!
Jun Zhang
Nankai University
coolrainbow_at_yahoo.cn
This archive was generated by hypermail 2.1.6 : Wed Feb 29 2012 - 15:56:42 CST