Package - molds
Primary informations
Download package: http://deb.debian.org/debian/pool/main/m/molds/molds_0.3.1-2+b1_amd64.deb (Size: 416.9KiB)| Property | Value |
|---|---|
| Package | molds |
| Source | molds (0.3.1-2) |
| Version | 0.3.1-2+b1 |
| Installed-Size | 1528 |
| Maintainer | Debichem Team |
| Architecture | amd64 |
| Depends | libboost-mpi1.83.0 (>= 1.83.0), libboost-serialization1.83.0 (>= 1.83.0), libboost-thread1.83.0 (>= 1.83.0), libc6 (>= 2.38), libgcc-s1 (>= 3.0), libgomp1 (>= 6), liblapacke (>= 3.12.0), libopenblas0, libopenmpi40 (>= 5.0.6), libstdc++6 (>= 14) |
| Description | Semi-empirical electronic structure and molecular dynamics |
| Description-md5 | e4dd2cae798824b2fe9bbef772b35774 |
| Homepage | https://osdn.net/projects/molds/ |
| Section | science |
| Priority | optional |
| Filename | pool/main/m/molds/molds_0.3.1-2+b1_amd64.deb |
| Size | 426904 |
| MD5sum | a2025170196596d374f33b3603ac82e4 |
| SHA256 | 9cc32ef29ab19888cb415ae13ae03ffe66d9a2875856b4266ab9174f41938092 |
Files in package
- /usr/bin/MolDS.out
- /usr/bin/molds
- /usr/share/doc/molds/README.txt.gz
- /usr/share/doc/molds/changelog.Debian.amd64.gz
- /usr/share/doc/molds/changelog.Debian.gz
- /usr/share/doc/molds/copyright
- /usr/share/doc/molds/examples/ch4_am1.in
- /usr/share/doc/molds/examples/ch4_am1_davidsonCIS_singlet.in
- /usr/share/doc/molds/examples/ch4_am1_directCIS_singlet.in
- /usr/share/doc/molds/examples/ch4_cndo2.in
- /usr/share/doc/molds/examples/ch4_indo.in
- /usr/share/doc/molds/examples/ch4_mndo.in
- /usr/share/doc/molds/examples/ch4_mndo_davidsonCIS_singlet.in
- /usr/share/doc/molds/examples/ch4_mndo_directCIS_singlet.in
- /usr/share/doc/molds/examples/ch4_pm3.in
- /usr/share/doc/molds/examples/ch4_pm3_davidsonCIS_singlet.in
- /usr/share/doc/molds/examples/ch4_pm3_directCIS_singlet.in
- /usr/share/doc/molds/examples/ch4_zindos_davidsonCIS_singlet.in
- /usr/share/doc/molds/examples/ch4_zindos_directCIS_singlet.in
- /usr/share/doc/molds/examples/h2o_zindos_directCIS_singlet.in
- /usr/share/doc/molds/examples/h2s_cndo2.in
- /usr/share/doc/molds/examples/h2s_zindos_davidsonCIS_singlet.in
- /usr/share/doc/molds/examples/h2s_zindos_directCIS_singlet.in
- /usr/share/lintian/overrides/molds