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Molecular Dynamics Showcase

By Michael McLennan1, Chen-Yu Li2, john stone3, Aleksei Aksimentiev2

1. Purdue University 2. University of Illinois at Urbana-Champaign 3. UIUC

View interesting features of a molecular dynamics trajectory file

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Version 1.0 - published on 08 Apr 2015

doi:10.4231/D3348GH3F cite this

Open source: license | download

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Usage

World usage

Location of all "Molecular Dynamics Showcase" Users Since Its Posting

Simulation Users

32

8 9 9 10 11 12 12 12 12 14 14 14 14 14 15 16 17 17 24 29 31 32 32

Users By Organization Type
Type Users
Educational - University 24 (72.73%)
Unidentified 8 (24.24%)
Industry 1 (3.03%)
Users by Country of Residence
Country Users
us UNITED STATES 23 (95.83%)
cn CHINA 1 (4.17%)

Simulation Runs

1,194

70 241 367 597 693 791 978 986 1036 1089 1095 1103 1123 1162 1252 1274 1302 1098 1168 1182 1192 1194 1194
Overview
Average Total
Wall Clock Time 4.48 hours 110.36 days
CPU time 4.81 minutes 1.97 days
Interaction Time 1.83 hours 45.12 days

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