[AMBER] MCPB

From: <chemjxn.126.com>
Date: Fri, 6 Feb 2015 16:21:14 +0800 (GMT+08:00)

Hello,
I'm studying the process of parameterization for Zn2+. I tried to repeat the example listed in AMBER website. When I performed the "MCPB -i 1AMP_OH_sidechain.bcl -l 1AMP_OH_sidechain.bcl.log" command, the error was found. "Error reading file 1AMP_OH_settings.bcl". But my 1AMP_OH_settings.bcl file is the same as the file listed in AMBER website. I don't know which step was wrong. Please help me. Thank you very much!


Jiang Xiao-Nan

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Received on Fri Feb 06 2015 - 00:30:02 PST
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