Molecular Energetics Group
References
[1] C.E.S. Bernardes, J.N. Canongia Lopes, M.E. Minas da Piedade;
J. Phys. Chem. A
2013
,
117
, 11107-11113.
[2] R.G. Simões, C.E.S. Bernardes, A. Joseph, M.F.M. Piedade, W. Kraus, F. Emmerling, H.P. Diogo, M.E. Minas da Piedade;
Mol. Pharmaceut.
2018
,
15
, 5349-5360.
[3] C.E.S. Bernardes, M.E. Minas da Piedade, J.N. Canongia Lopes;
J. Phys. Chem. B
2012
,
116
, 5179-5184.
[4] C.E.S. Bernardes, J.N. Canongia Lopes;
J. Chem. Theory Comp.
2017
,
13
, 6167-6176.
[5] C.E.S. Bernardes;
J. Comp. Chem.
2017
,
38
, 753-765.
Computational chemistry
Software
References