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11 lines
475 B
Plaintext
11 lines
475 B
Plaintext
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Pymbd is Python bindings for Libmbd.
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Libmbd implements the many-body dispersion (MBD) method in several
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programming languages and frameworks:
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The Fortran implementation is the reference, most advanced
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implementation, with support for analytical gradients and distributed
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parallelism, and additional functionality beyond the MBD method
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itself. It provides a low-level and a high-level Fortran API, as well
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as a C API. Furthermore, Python bindings to the C API are provided.
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