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Open3DALIGN x64 2.28 Paolo Tosco    

Open3DALIGN x64 is an open-source software aimed at unsupervised molecular alignment. Open3DALIGN is a command-line tool which is ... for each compound of the dataset a quenched molecular dynamics (QMD) conformational search is carried out to find ... search is accomplished running a number of short molecular dynamics runs (using the MMFF94 force-field) followed by .... Free download of Open3DALIGN x64 2.28

x64 molecular dynamics web results