This is the official repository of the modern open-source version of MOPAC, which is now released under an Apache license (versions 22.0.0 through 23.0.3 are available under an LGPL license). This is ...
In my master's thesis I used Hamiltonian replica exchange molecular dynamics (HREMD) to understand the interaction mechanism of two proteins: an epitope of the Plasmodium falciparum AMA1 protein and a ...
Edited by Peter Stang, The University of Utah, Salt Lake City, UT; received June 28, 2023; accepted September 28, 2023 2 5 mol% Pd(dba) 2, and 10 mol% DavePhos in toluene, 100 °C, 12 h 37:21:42 8 10 ...
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