[ bianca ]
[ 原始碼: cpptraj ]
套件:cpptraj(5.1.0+dfsg-4 以及其他的)
fast, parallelized molecular dynamics trajectory data analysis
CPPTRAJ is a program designed to process and analyze molecular dynamics trajectories and relevant data sets derived from their analysis. CPPTRAJ supports many popular MD software packages including Amber, CHARMM, Gromacs, and NAMD.
其他與 cpptraj 有關的套件
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- dep: libarpack2t64 (>= 2.1)
- Fortran77 subroutines to solve large scale eigenvalue problems
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- dep: libbz2-1.0
- high-quality block-sorting file compressor library - runtime
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- dep: libc6 (>= 2.38)
- GNU C Library: Shared libraries
同時作為一個虛擬套件由這些套件填實: libc6-udeb
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- dep: libfftw3-double3 (>= 3.3.10)
- Library for computing Fast Fourier Transforms - Double precision
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- dep: libgcc-s1 (>= 3.0)
- GCC support library
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- dep: liblapack3
- Library of linear algebra routines 3 - shared version
- 或者 liblapack.so.3
- 本虛擬套件由這些套件填實: liblapack3, libopenblas0-openmp, libopenblas0-pthread, libopenblas0-serial
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- dep: libnetcdf22 (>= 3.6.1)
- Interface for scientific data access to large binary data
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- dep: libopenmm8.1 (>= 8.1.2+dfsg)
- High-performance molecular simulation library
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- dep: libreadline8t64 (>= 6.0)
- GNU readline and history libraries, run-time libraries
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- dep: libstdc++6 (>= 13.1)
- GNU Standard C++ Library v3
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- dep: zlib1g (>= 1:1.2.3.4)
- compression library - runtime