From: Miguel <mi...@jm...> - 2004-05-20 13:00:13
|
>>>A few months ago Henry said that he needed MOPAC files. >>> >>>Q: Do we have any MOPAC files in the samples directory? >>> >>>Q: Do you know where we can get a couple of them. A small one and a >>> larger one? >> >>I assume you mean MOPAC output files. Correct ... I only want the output. >> We have lots of them. Note that >> there are likely to be differences between versions of the program so >> there tends to be a need to continually update readers. Ours are version >> 2003. YY (copied) can send you one if required. > > I think Peter means MOPAC 2002. > I also have a beta copy of MOPAC 2005 which I will forward shortly Peter is correct ... I only want the output. It would be good to have output from a small molecule and from a medium/large molecule. This pair of files for each version of MOPAC. Miguel |