D for project in computational chemistry
Yura via Digitalmars-d
digitalmars-d at puremagic.com
Sun Aug 2 09:25:16 PDT 2015
Dear D coders/developers,
I am just thinking on one project in computational chemistry, and
it is sort of difficult for me to pick up the right language this
project to be written. The project is going to deal with the
generation of the molecular structures and will resemble to some
extent some bio-informatic stuff. Personally I code in two
languages - Python, and a little bit in C (just started to learn
this language).
While it is easy to code in Python there are two things I do not
like:
1) Python is slow for nested loops (much slower comparing to C)
2) Python is not compiled. However, I want to work with a code
which can be compiled and distributed as binaries (at least at
the beginning).
When it comes to C, it is very difficult to code (I am a chemist
rather than computer scientist). The pointers, memory allocation,
absence of the truly dynamically allocated arrays, etc, etc make
the coding very long. C is too low level I believe.
I just wander how D would be suitable for my purpose? Please,
correct me if I am wrong, but in D the need of pointers is
minimal, there is a garbage collector, the arrays can be
dynamically allocated, the arrays can be sliced, ~=, etc which
makes it similar to python at some extent. I tried to write a
little code in D and it was very much intuitive and similar to
what I did both in Python and C.
Any hints/thoughts/advises?
With kind regards,
Yury
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