Yudhajit Pal

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icon location Madison WI icon location Currently working as a Data Scientist. Formerly postdoc at UW-Madison Chemistry and PhD at SUNY-Buffalo CBE.

Results 2 comments of Yudhajit Pal

Using megnet for systems having atoms apart from "H", "C", "N", "O", "F"

@chc273 Hi, I tried it out and adjusted the feature dimension for the nodes as well as edges as required. However, on a separate note, I did not get satisfactory...

Using megnet for systems having atoms apart from "H", "C", "N", "O", "F"

Ok, I actually resolved this issue looking at some other example codes in the notebook folder. Thanks for your help! Yudhajit