[gmx-users] Re: Fatal Error: Residue 'DMP' not found in residue topology database

Justin Lemkul jalemkul at vt.edu
Wed Sep 25 00:39:43 CEST 2013



On 9/23/13 11:43 PM, Santhosh Kumar Nagarajan wrote:
> Justin..
> I understand the problem..
> But.. How to generate a .rtp file myself..
>

Study existing examples, read manual section 5.6.1, and fire up a text editor.

-Justin

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Justin A. Lemkul, Ph.D.
Postdoctoral Fellow

Department of Pharmaceutical Sciences
School of Pharmacy
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University of Maryland, Baltimore
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jalemkul at outerbanks.umaryland.edu | (410) 706-7441

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