The CORAL is freeware to build up quantitative structure-property activity relationships (QSPR /QSAR). It gives the possibility to build up models for endpoints related to nanomaterials. The CORAL software has been developed at the Department […]
Read moreCongratulations to our students Juganta Roy and Micah Anderson for winning top places for their poster presentations at the 2018 International Conference on Current Trends in Computational Chemistry, held at the Jackson State University on […]
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Welcome We are pleased to announce the ICN workshop. The “Introduction to Molecular dynamics” workshop is devoted to specific lecture that will introduce basic MD techniques and DFT simulations methods. It will provide to graduated […]
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Dr. Jerzy Leszczynski and Dr. Shonda Allen visited the Engineer Research and Development Center (ERDC) on Wednesday, September 5th, 2018. They presented Dr. David Horner, Director of the U.S. Army Engineer Research and Development Center’s Information […]
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