DebiChem Project
Summary
C/C++/Fortran Development
DebiChem C/C++/Fortran Development

This metapackage will install development packages useful for chemists.

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Description

For a better overview of the project's availability as a Debian package, each head row has a color code according to this scheme:

If you discover a project which looks like a good candidate for DebiChem to you, or if you have prepared an unofficial Debian package, please do not hesitate to send a description of that project to the DebiChem mailing list

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DebiChem C/C++/Fortran Development packages

Official Debian packages with high relevance

libblas-dev
??? missing short description for package libblas-dev :-(
Versions of package libblas-dev
ReleaseVersionArchitectures
trixie3.12.1-6amd64,arm64,armel,armhf,i386,ppc64el,riscv64,s390x
bullseye3.9.0-3+deb11u1amd64,arm64,armhf,i386
bookworm3.11.0-2amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x
forky3.12.1-7amd64,arm64,armhf,i386,loong64,ppc64el,riscv64,s390x
sid3.12.1-7amd64,arm64,armhf,i386,loong64,ppc64el,riscv64,s390x
Debtags of package libblas-dev:
devellibrary
roledevel-lib
Popcon: 342 users (958 upd.)*
Versions and Archs
 License: DFSG free
Git
Please cite: E. Anderson, Z. Bai, C. Bischof, S. Blackford, J. Demmel, J. Dongarra, J. Du Croz, A. Greenbaum, S. Hammarling, A. McKenney and D. Sorensen: LAPACK Users' Guide (1999)
libbtas-dev
??? missing short description for package libbtas-dev :-(
Versions of package libbtas-dev
ReleaseVersionArchitectures
sid1.0.0-1.1amd64,armhf,i386,loong64,s390x
sid1.0.0-1arm64,ppc64el,riscv64
Popcon: 0 users (0 upd.)*
Versions and Archs
 License: DFSG free
Git
libdbcsr-dev
??? missing short description for package libdbcsr-dev :-(
Versions of package libdbcsr-dev
ReleaseVersionArchitectures
bookworm2.5.0-1amd64,arm64,armhf,i386,mips64el,mipsel,ppc64el,s390x
sid2.9.1-1amd64,arm64,armhf,i386,loong64,ppc64el,riscv64,s390x
forky2.9.1-1amd64,arm64,armhf,i386,loong64,ppc64el,riscv64,s390x
trixie2.8.0-3amd64,arm64,armel,armhf,i386,ppc64el,riscv64,s390x
Popcon: users ( upd.)*
Versions and Archs
 License: DFSG free
Git
libelpa-dev
??? missing short description for package libelpa-dev :-(
Versions of package libelpa-dev
ReleaseVersionArchitectures
sid2022.11.001-4amd64,arm64,loong64,ppc64el,riscv64,s390x
experimental2024.05.001-1amd64,arm64,armhf,i386,loong64,ppc64el,riscv64,s390x
bullseye2019.11.001-4amd64,arm64,armhf,i386
bookworm2022.11.001-2+deb12u1amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x
trixie2022.11.001-4amd64,arm64,ppc64el,riscv64,s390x
forky2022.11.001-4amd64,arm64,ppc64el,riscv64,s390x
upstream2026.02.001
Popcon: 1 users (3 upd.)*
Newer upstream!
 License: DFSG free
Git
Please cite: T. Auckenthaler, V. Blum, H.-J. Bungartz, T. Huckle, R. Johanni, L. Krämer, B. Lang, H. Lederer and P. R. Willems: Parallel solution of partial symmetric eigenvalue problems from electronic structure calculations. Parallel Computing 37:783-794 (2011)
libfftw3-dev
??? missing short description for package libfftw3-dev :-(
Versions of package libfftw3-dev
ReleaseVersionArchitectures
trixie3.3.10-2amd64,arm64,armel,armhf,i386,ppc64el,riscv64,s390x
bullseye3.3.8-2amd64,arm64,armhf,i386
sid3.3.10-2amd64,arm64,armhf,i386,loong64,ppc64el,riscv64,s390x
forky3.3.10-2amd64,arm64,armhf,i386,loong64,ppc64el,riscv64,s390x
bookworm3.3.10-1amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x
upstream3.3.11.
Debtags of package libfftw3-dev:
devellibrary
roledevel-lib
Popcon: 432 users (662 upd.)*
Newer upstream!
 License: DFSG free
Git
Please cite: Matteo Frigo and Steven G. Johnson: The Design and Implementation of FFTW3. (eprint) 93(2):216–231 (2005)
Registry entries: SciCrunch 
libga-dev
??? missing short description for package libga-dev :-(
Versions of package libga-dev
ReleaseVersionArchitectures
sid2.4.7-6amd64,arm64,armhf,i386,loong64,ppc64el,riscv64,s390x
bullseye2.4.7-4amd64,arm64,armhf,i386
trixie2.4.7-6amd64,arm64,armel,armhf,i386,ppc64el,riscv64,s390x
forky2.4.7-6amd64,arm64,armhf,i386,loong64,ppc64el,riscv64,s390x
bookworm2.4.7-6amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x
Debtags of package libga-dev:
devellibrary
roledevel-lib
Popcon: 9 users (107 upd.)*
Versions and Archs
 License: DFSG free
Git
libint-dev
??? missing short description for package libint-dev :-(
Versions of package libint-dev
ReleaseVersionArchitectures
trixie1.2.1-6amd64,arm64,armel,armhf,i386,ppc64el,riscv64,s390x
sid1.2.1-7amd64,arm64,armhf,i386,loong64,ppc64el,riscv64,s390x
bullseye1.2.1-6amd64,arm64,armhf,i386
bookworm1.2.1-6amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x
forky1.2.1-7amd64,arm64,armhf,i386,loong64,ppc64el,riscv64,s390x
Debtags of package libint-dev:
devellibrary
roledevel-lib
Popcon: 2 users (1 upd.)*
Versions and Archs
 License: DFSG free
Git
libint2-dev
??? missing short description for package libint2-dev :-(
Maintainer: Debichem Team (Adrian Bunk)
Versions of package libint2-dev
ReleaseVersionArchitectures
forky2.7.2-1.2amd64,arm64,armhf,i386,ppc64el,riscv64,s390x
sid2.7.2-1.2amd64,arm64,armhf,i386,loong64,ppc64el,riscv64,s390x
trixie2.7.2-1.1amd64,arm64,armel,armhf,i386,ppc64el,riscv64,s390x
bookworm2.7.2-1amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x
bullseye2.6.0-13amd64,arm64,armhf,i386
upstream2.13.1
Popcon: 2 users (3 upd.)*
Newer upstream!
 License: DFSG free
Git
liblapack-dev
??? missing short description for package liblapack-dev :-(
Versions of package liblapack-dev
ReleaseVersionArchitectures
trixie3.12.1-6amd64,arm64,armel,armhf,i386,ppc64el,riscv64,s390x
bullseye3.9.0-3+deb11u1amd64,arm64,armhf,i386
bookworm3.11.0-2amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x
forky3.12.1-7amd64,arm64,armhf,i386,loong64,ppc64el,riscv64,s390x
sid3.12.1-7amd64,arm64,armhf,i386,loong64,ppc64el,riscv64,s390x
Debtags of package liblapack-dev:
devellibrary
roledevel-lib
Popcon: 233 users (409 upd.)*
Versions and Archs
 License: DFSG free
Git
Please cite: E. Anderson, Z. Bai, C. Bischof, S. Blackford, J. Demmel, J. Dongarra, J. Du Croz, A. Greenbaum, S. Hammarling, A. McKenney and D. Sorensen: LAPACK Users' Guide (1999)
libmadness-dev
??? missing short description for package libmadness-dev :-(
Versions of package libmadness-dev
ReleaseVersionArchitectures
sid0.10.1+git20200818.eee5fd9f-4amd64,arm64,armhf,i386,loong64,ppc64el,riscv64,s390x
bookworm0.10.1+git20200818.eee5fd9f-3amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x
bullseye0.10.1+git20200818.eee5fd9f-2amd64,arm64,armhf,i386
trixie0.10.1+git20200818.eee5fd9f-3amd64,arm64,armel,armhf,i386,ppc64el,riscv64,s390x
forky0.10.1+git20200818.eee5fd9f-4amd64,arm64,armhf,i386,loong64,ppc64el,riscv64,s390x
Popcon: 2 users (1 upd.)*
Versions and Archs
 License: DFSG free
Git
libopenmm-dev
??? missing short description for package libopenmm-dev :-(
Versions of package libopenmm-dev
ReleaseVersionArchitectures
bullseye7.5.0+dfsg-1amd64,arm64
sid8.1.2+dfsg-12amd64,arm64,armhf,i386,loong64,ppc64el,riscv64,s390x
forky8.1.2+dfsg-12amd64,arm64,armhf,i386,loong64,ppc64el,riscv64,s390x
trixie8.1.2+dfsg-11amd64,arm64,armel,armhf,i386,ppc64el,riscv64,s390x
bookworm7.7.0+dfsg-9amd64,arm64,ppc64el
upstream8.5.1
Popcon: 4 users (36 upd.)*
Newer upstream!
 License: DFSG free
Git
Please cite: P. Eastman, J. Swails, J. D. Chodera, R. T. McGibbon, Y. Zhao, K. A. Beauchamp, L.-P. Wang, A. C. Simmonett, M. P. Harrigan, C. D. Stern, R. P. Wiewiora, B. R. Brooks and V. S. Pande: OpenMM 7: Rapid development of high performance algorithms for molecular dynamics. (PubMed,eprint) PLOS Comp. Biol. 13(7):e1005659 (2017)
Registry entries: Bio.tools  SciCrunch 
libpsi3-dev
??? missing short description for package libpsi3-dev :-(
Versions of package libpsi3-dev
ReleaseVersionArchitectures
bullseye3.4.0-6amd64,arm64,armhf,i386
bookworm3.4.0-6amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x
Popcon: 2 users (0 upd.)*
Versions and Archs
 License: DFSG free
Svn
libsc-dev
??? missing short description for package libsc-dev :-(
Versions of package libsc-dev
ReleaseVersionArchitectures
sid2.3.1-22amd64,arm64,armhf,i386,ppc64el,riscv64,s390x
bullseye2.3.1-21amd64,arm64,armhf,i386
bookworm2.3.1-22amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x
Debtags of package libsc-dev:
devellang:c++, library
roledevel-lib
Popcon: 0 users (0 upd.)*
Versions and Archs
 License: DFSG free
Git
Please cite: The Massively Parallel Quantum Chemistry Program (MPQC), Version 2.3.1, Curtis L. Janssen, Ida B. Nielsen, Matt L. Leininger, Edward F. Valeev, Joseph P. Kenny, Edward T. Seidl, Sandia National Laboratories, Livermore, CA. (2008)
libscalapack-mpi-dev
??? missing short description for package libscalapack-mpi-dev :-(
Versions of package libscalapack-mpi-dev
ReleaseVersionArchitectures
sid2.2.3-5amd64,arm64,armhf,i386,loong64,ppc64el,riscv64,s390x
forky2.2.3-5amd64,arm64,armhf,i386,ppc64el,riscv64,s390x
trixie2.2.2-1amd64,arm64,armel,armhf,i386,ppc64el,riscv64,s390x
bookworm2.2.1-2amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x
bullseye2.1.0-4amd64,arm64,armhf,i386
Debtags of package libscalapack-mpi-dev:
devellibrary
roledevel-lib
Popcon: 49 users (119 upd.)*
Versions and Archs
 License: DFSG free
Git
libsimtkmolmodel-dev
??? missing short description for package libsimtkmolmodel-dev :-(
Versions of package libsimtkmolmodel-dev
ReleaseVersionArchitectures
trixie3.1.0-4.1amd64,arm64,armhf,i386,ppc64el,riscv64,s390x
sid3.1.0-5amd64,arm64,armhf,i386,loong64,ppc64el,riscv64,s390x
bullseye3.0~svn842-2amd64,arm64,armhf,i386
bookworm3.1.0-2amd64,arm64
forky3.1.0-5amd64,arm64,armhf,i386,loong64,ppc64el,riscv64,s390x
Popcon: 1 users (1 upd.)*
Versions and Archs
 License: DFSG free
Git
libsymspg-dev
??? missing short description for package libsymspg-dev :-(
Versions of package libsymspg-dev
ReleaseVersionArchitectures
sid2.7.0-1amd64,arm64,armhf,i386,loong64,ppc64el,riscv64,s390x
bookworm2.0.2-1amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x
bullseye1.16.1-1amd64,arm64,armhf,i386
trixie2.6.0-3amd64,arm64,armel,armhf,i386,ppc64el,riscv64,s390x
forky2.7.0-1amd64,arm64,armhf,i386,loong64,ppc64el,riscv64,s390x
Popcon: 2 users (7 upd.)*
Versions and Archs
 License: DFSG free
Git
Please cite: Atsushi Togo and Isao Tanaka: Spglib: a software library for crystal symmetry search. (2018)
libtiledarray-dev
??? missing short description for package libtiledarray-dev :-(
Maintainer: Debichem Team (Adrian Bunk)
Versions of package libtiledarray-dev
ReleaseVersionArchitectures
sid0.6.0-5.2amd64,arm64,armhf,i386,ppc64el,s390x
Popcon: 1 users (1 upd.)*
Versions and Archs
 License: DFSG free
Svn
Please cite: Justus A. Calvin and Edward F. Valeev: TiledArray: A general-purpose scalable block-sparse tensor framework. (2008)
libtrexio-dev
??? missing short description for package libtrexio-dev :-(
Versions of package libtrexio-dev
ReleaseVersionArchitectures
forky2.2.3-3amd64,arm64,armhf,i386,ppc64el,riscv64,s390x
sid2.2.3-3amd64,arm64,armhf,i386,loong64,ppc64el,riscv64,s390x
trixie2.2.3-3amd64,arm64,armel,armhf,i386,ppc64el,riscv64,s390x
bookworm2.2.3-3amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x
upstream2.6.1
Popcon: 0 users (1 upd.)*
Newer upstream!
 License: DFSG free
Git
libxc-dev
??? missing short description for package libxc-dev :-(
Maintainer: Debichem Team (Adrian Bunk)
Versions of package libxc-dev
ReleaseVersionArchitectures
bookworm5.2.3-1amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x
trixie5.2.3-3amd64,arm64,armel,armhf,i386,ppc64el,riscv64,s390x
forky5.2.3-3.1amd64,arm64,armhf,i386,loong64,ppc64el,riscv64,s390x
sid5.2.3-3.1amd64,arm64,armhf,i386,loong64,ppc64el,riscv64,s390x
experimental7.0.0-1amd64,arm64,armhf,i386,ppc64el,riscv64,s390x
bullseye4.3.4-2amd64,arm64,armhf,i386
Debtags of package libxc-dev:
devellibrary
roledevel-lib
Popcon: 8 users (9 upd.)*
Versions and Archs
 License: DFSG free
Git
mpi-default-dev
??? missing short description for package mpi-default-dev :-(
Versions of package mpi-default-dev
ReleaseVersionArchitectures
sid1.20amd64,arm64,armhf,i386,loong64,ppc64el,riscv64,s390x
forky1.20amd64,arm64,armhf,i386,ppc64el,riscv64,s390x
trixie1.18amd64,arm64,armel,armhf,i386,ppc64el,riscv64,s390x
bookworm1.14amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x
bullseye1.13amd64,arm64,armhf,i386
Debtags of package mpi-default-dev:
devellibrary
roledevel-lib
Popcon: 169 users (187 upd.)*
Versions and Archs
 License: DFSG free
Git
*Popularitycontest results: number of people who use this package regularly (number of people who upgraded this package recently) out of 284106