Key | Value |
---|---|
FileName | ./usr/bin/xplor2gmx.pl |
FileSize | 9008 |
MD5 | 4549202F35A8206562CC92B7F5DC922B |
SHA-1 | 89CDAF79341512215F76263451A12CE5423D1417 |
SHA-256 | B7E3AE9F625DCB9DCF386E1E661EC343C91C3F7121942A597108DEE027FB0EA5 |
SSDEEP | 192:qGwsu17DsOQenIQ0leVC4QF+QZn1Zug27ThB:qzsu17FQe8LugMB |
TLSH | T157027591A3CEC2275227A271E6C84D4C8A2F84B31BD079187E8C55857F4C13D937BEBA |
hashlookup:parent-total | 64 |
hashlookup:trust | 100 |
The searched file hash is included in 64 parent files which include package known and seen by metalookup. A sample is included below:
Key | Value |
---|---|
FileSize | 138532 |
MD5 | 310D78CC331ADAFAC784998BA103F1CF |
PackageDescription | Molecular dynamics simulator, with building and analysis tools GROMACS is a versatile package to perform molecular dynamics, i.e. simulate the Newtonian equations of motion for systems with hundreds to millions of particles. . It is primarily designed for biochemical molecules like proteins and lipids that have a lot of complicated bonded interactions, but since GROMACS is extremely fast at calculating the nonbonded interactions (that usually dominate simulations) many groups are also using it for research on non- biological systems, e.g. polymers. |
PackageMaintainer | Debichem Team <debichem-devel@lists.alioth.debian.org> |
PackageName | gromacs |
PackageSection | science |
PackageVersion | 2021.3-3 |
SHA-1 | 07774D80D8E182EAFDBF01ABBEB0F1DD3E926259 |
SHA-256 | 70817C8A18BC65664370C53B9F7DF3F3DA5AAF9177A1021BFB59CD49649C9604 |
Key | Value |
---|---|
FileSize | 144148 |
MD5 | 2F717FAF86684B298F8157B733ABB999 |
PackageDescription | Molecular dynamics simulator, with building and analysis tools GROMACS is a versatile package to perform molecular dynamics, i.e. simulate the Newtonian equations of motion for systems with hundreds to millions of particles. . It is primarily designed for biochemical molecules like proteins and lipids that have a lot of complicated bonded interactions, but since GROMACS is extremely fast at calculating the nonbonded interactions (that usually dominate simulations) many groups are also using it for research on non- biological systems, e.g. polymers. |
PackageMaintainer | Debichem Team <debichem-devel@lists.alioth.debian.org> |
PackageName | gromacs |
PackageSection | science |
PackageVersion | 2020.6-2 |
SHA-1 | 0AD09D0288C759828706E42079D51F4DAD07E78F |
SHA-256 | BAF8A6BEC0A619EC7F1AB6AD79B842ABA0F2A1FB8CD8822E3AA0439709B07143 |
Key | Value |
---|---|
FileSize | 122700 |
MD5 | C0E516EBB2844B44EA4485D7D9A2FF30 |
PackageDescription | Molecular dynamics simulator, with building and analysis tools GROMACS is a versatile package to perform molecular dynamics, i.e. simulate the Newtonian equations of motion for systems with hundreds to millions of particles. . It is primarily designed for biochemical molecules like proteins and lipids that have a lot of complicated bonded interactions, but since GROMACS is extremely fast at calculating the nonbonded interactions (that usually dominate simulations) many groups are also using it for research on non- biological systems, e.g. polymers. |
PackageMaintainer | Debichem Team <debichem-devel@lists.alioth.debian.org> |
PackageName | gromacs |
PackageSection | science |
PackageVersion | 2019.1-1 |
SHA-1 | 0FDA37AB126C9218FA38FCC08A54BB4AB56423E1 |
SHA-256 | 7E48BDB52EBD18C68679E157D89F83F27035ECEED620C4078E26B979CEA3F771 |
Key | Value |
---|---|
FileSize | 123964 |
MD5 | 1787385484370A3079790172AB1BA37C |
PackageDescription | Molecular dynamics simulator, with building and analysis tools GROMACS is a versatile package to perform molecular dynamics, i.e. simulate the Newtonian equations of motion for systems with hundreds to millions of particles. . It is primarily designed for biochemical molecules like proteins and lipids that have a lot of complicated bonded interactions, but since GROMACS is extremely fast at calculating the nonbonded interactions (that usually dominate simulations) many groups are also using it for research on non- biological systems, e.g. polymers. |
PackageMaintainer | Debichem Team <debichem-devel@lists.alioth.debian.org> |
PackageName | gromacs |
PackageSection | science |
PackageVersion | 2021.3-3 |
SHA-1 | 10435B5371A8A8741E0A36832B870178F53EA365 |
SHA-256 | 1FDEF479D0B644CA84E935313FEBBC9A02CB15F2A91AFE202B59CA7D0476BE79 |
Key | Value |
---|---|
FileSize | 134020 |
MD5 | 48EF9A7C4692DD1C927BC6E0B6E1662A |
PackageDescription | Molecular dynamics simulator, with building and analysis tools GROMACS is a versatile package to perform molecular dynamics, i.e. simulate the Newtonian equations of motion for systems with hundreds to millions of particles. . It is primarily designed for biochemical molecules like proteins and lipids that have a lot of complicated bonded interactions, but since GROMACS is extremely fast at calculating the nonbonded interactions (that usually dominate simulations) many groups are also using it for research on non- biological systems, e.g. polymers. |
PackageMaintainer | Debichem Team <debichem-devel@lists.alioth.debian.org> |
PackageName | gromacs |
PackageSection | science |
PackageVersion | 2020.6-2 |
SHA-1 | 14239F6C2BDEEECCE31131BEA48164B9D0014029 |
SHA-256 | 2A342E57892193DF268444107C509D8CB93352CA957FA1ED4264D7B2AA2F0D2A |
Key | Value |
---|---|
MD5 | DBF829CA29054343F70D9C274CDAA2F4 |
PackageArch | aarch64 |
PackageDescription | GROMACS is a versatile and extremely well optimized package to perform molecular dynamics computer simulations and subsequent trajectory analysis. It is developed for bio-molecules like proteins, but the extremely high performance means it is used also in several other field like polymer chemistry and solid state physics. This package provides single and double precision binaries. The documentation is in the package gromacs-common. mdrun has been compiled with thread parallellization, so it runs in parallel on shared memory systems. If you want to run on a cluster, you probably want to install one of the MPI parallellized packages. N.B. All binaries have names starting with g_, for example mdrun has been renamed to g_mdrun. |
PackageMaintainer | Fedora Project |
PackageName | gromacs |
PackageRelease | 1.fc32 |
PackageVersion | 2019.6 |
SHA-1 | 180E1139E9CE326B114136C739C46F5357C05AFF |
SHA-256 | 2322376E0CCB52FD985D98125C24C657B52EA516AAD6942DD868DF71290D6D2B |
Key | Value |
---|---|
FileSize | 136208 |
MD5 | AE3A2E38942D6CF726B3765413E14891 |
PackageDescription | Molecular dynamics simulator, with building and analysis tools GROMACS is a versatile package to perform molecular dynamics, i.e. simulate the Newtonian equations of motion for systems with hundreds to millions of particles. . It is primarily designed for biochemical molecules like proteins and lipids that have a lot of complicated bonded interactions, but since GROMACS is extremely fast at calculating the nonbonded interactions (that usually dominate simulations) many groups are also using it for research on non- biological systems, e.g. polymers. |
PackageMaintainer | Debichem Team <debichem-devel@lists.alioth.debian.org> |
PackageName | gromacs |
PackageSection | science |
PackageVersion | 2020.6-2 |
SHA-1 | 197970FBCC62ACC9BEDB867E26E1BF47A72AAE58 |
SHA-256 | C8309FF461171B59915DB17CE0F1A2310C615A6D194401A7E026507ECB5B1924 |
Key | Value |
---|---|
FileSize | 148108 |
MD5 | 2C3BBBDD4960E99783D678BB40C3E388 |
PackageDescription | Molecular dynamics simulator, with building and analysis tools GROMACS is a versatile package to perform molecular dynamics, i.e. simulate the Newtonian equations of motion for systems with hundreds to millions of particles. . It is primarily designed for biochemical molecules like proteins and lipids that have a lot of complicated bonded interactions, but since GROMACS is extremely fast at calculating the nonbonded interactions (that usually dominate simulations) many groups are also using it for research on non- biological systems, e.g. polymers. |
PackageMaintainer | Debichem Team <debichem-devel@lists.alioth.debian.org> |
PackageName | gromacs |
PackageSection | science |
PackageVersion | 2021.4-2 |
SHA-1 | 1FEBAF950BFDF78D9A9708AA116F927223DE686F |
SHA-256 | FCB65C0D064309F983E34284404548838055930BFF3658FB1683067E3F29E171 |
Key | Value |
---|---|
MD5 | FDDCA802A20478292250710184C937A7 |
PackageArch | x86_64 |
PackageDescription | GROMACS is a versatile and extremely well optimized package to perform molecular dynamics computer simulations and subsequent trajectory analysis. It is developed for bio-molecules like proteins, but the extremely high performance means it is used also in several other field like polymer chemistry and solid state physics. This package provides single and double precision binaries. The documentation is in the package gromacs-common. mdrun has been compiled with thread parallellization, so it runs in parallel on shared memory systems. If you want to run on a cluster, you probably want to install one of the MPI parallellized packages. N.B. All binaries have names starting with g_, for example mdrun has been renamed to g_mdrun. |
PackageMaintainer | Fedora Project |
PackageName | gromacs |
PackageRelease | 1.el8 |
PackageVersion | 2019.4 |
SHA-1 | 241A67D8CF47BA34DE7D5E28481843B03FD13A62 |
SHA-256 | ED817F6443BE442EC3EEFE7D0AFEC8CFB46D7424019201B2B11EABD1870807E5 |
Key | Value |
---|---|
MD5 | E4DA39F066940A0A36642372ED9F1389 |
PackageArch | aarch64 |
PackageDescription | GROMACS is a versatile and extremely well optimized package to perform molecular dynamics computer simulations and subsequent trajectory analysis. It is developed for bio-molecules like proteins, but the extremely high performance means it is used also in several other field like polymer chemistry and solid state physics. This package provides single and double precision binaries. The documentation is in the package gromacs-common. mdrun has been compiled with thread parallellization, so it runs in parallel on shared memory systems. If you want to run on a cluster, you probably want to install one of the MPI parallellized packages. N.B. All binaries have names starting with g_, for example mdrun has been renamed to g_mdrun. |
PackageMaintainer | Fedora Project |
PackageName | gromacs |
PackageRelease | 9.fc34 |
PackageVersion | 2019.6 |
SHA-1 | 291E6F01AAAE3C2AC2F6415749F328CF883C010E |
SHA-256 | CCED74E2022A7066C829CFA862373E41A2C722E5564F116FD42510D1D9A37356 |