Key | Value |
---|---|
FileSize | 203956 |
MD5 | 6642B377A25E3016C05D58BAA06AAD91 |
PackageDescription | GROMACS molecular dynamics sim, development kit 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. . This package contains header files and static libraries for development purposes, plus sample Makefiles. Development components for MPI-enabled GROMACS builds also require their respective packages. |
PackageMaintainer | Debichem Team <debichem-devel@lists.alioth.debian.org> |
PackageName | libgromacs-dev |
PackageSection | libdevel |
PackageVersion | 2016.1-2 |
SHA-1 | 07B00E9794C3E5B6DA3CA4C138FF08022D3D6572 |
SHA-256 | F75028200FA4894C29FB6138DA9D817C323F9E6B9A60FA0FCE54B7907FD448BF |
hashlookup:children-total | 140 |
hashlookup:trust | 50 |
The searched file hash includes 140 children files known and seen by metalookup. A sample is included below:
Key | Value |
---|---|
FileName | ./usr/include/gromacs/options/optionfiletype.h |
FileSize | 2292 |
MD5 | EB98D1CE254B2BACEFA3FF19A9E53D9F |
SHA-1 | 00544F525A77DC9DA508BD46BC897E6F8BE40BFF |
SHA-256 | 09DE25A08EC478BDBE03FE803B61D056A4CC5C6AD7108BF51B0810728C3FA8F3 |
SSDEEP | 24:I3rBpFx09/+7ovZX0B2FqvXyXOkH22TbV7wW53q6tL6+3gMqsdBTwovv0goAV110:Crf0Eem2syxHDk6F6QNqbov8qjJ1taMy |
TLSH | T1C941520E2685437744C206D8734D59D9922AC7EB75AAB490505EC62C6F0CCAE5BF3EC4 |
Key | Value |
---|---|
FileName | ./usr/include/gromacs/mdtypes/inputrec.h |
FileSize | 30305 |
MD5 | 289EC36A970B06E73638A6AC9FF1FD7C |
SHA-1 | 03F27CD735D0B15750F67BC2877FDA64AF11491B |
SHA-256 | BCEEC3B2357FDCA6F4DCFF3E7118358BA3EF15FFD3E15EC4F26DAA6CEAA03DD7 |
SSDEEP | 384:CN21MICzYadMUJX81JwLbQ7/g+v8oEZHQUHe2F+AhXr:i21MjznBX8Co/g+v8QuFvhb |
TLSH | T189D2FE065EF3433746528675FBD96081A629D26BA7D0B4C47C2E83386F02B6863F9BD1 |
Key | Value |
---|---|
FileName | ./usr/include/gromacs/fileio/trxio.h |
FileSize | 9579 |
MD5 | E308EC4723878144751FD83E24A05AFE |
SHA-1 | 03F84DBC12920AB7B5E270C1C0686BF7646B4C6E |
SHA-256 | 114E2F78346814E8F1097868099528425626DADF6D1C3D08606F827287E4AA97 |
SSDEEP | 192:CW21QQt4fOyWBOe8RubyeijNStHa8+V+Qe/k0k0cGHFk6Noe4:CW21n4WycOe8YyBkHa8+V+Qe/1k0cGl8 |
TLSH | T1AC12A50F24591F3644D247A0A20E45D66B05C5AA76B7A594300DF2783F0D9EFE2BAFCE |
Key | Value |
---|---|
FileName | ./usr/include/gromacs/utility/baseversion.h |
FileSize | 3620 |
MD5 | 0DEAC2B879441FB79F57AA59538DC3D6 |
SHA-1 | 0D8DB4AE14917E577599EC82AB13004CC8D9FD9C |
SHA-256 | FAF28C29E907A5C16473A30806A0413752B189599963D659A6E060DA0B400CD3 |
SSDEEP | 48:CrI0Eem2syxHDk6F6QNqbov8qjd04C4n4/KWEoI/ep/4qXSr3/zEUPQjridU5Brw:CE721QMEboEqjmXRUULkYP2dcI7vDp |
TLSH | T1F671646E22455337048207D4F3CD1AC6D719D5797339A090A86FC2AC5D0ACEAC7B7ED1 |
Key | Value |
---|---|
FileName | ./usr/include/gromacs/analysisdata/modules/displacement.h |
FileSize | 4158 |
MD5 | 4260569CA4130FB933936473E312A5C5 |
SHA-1 | 0E3B0D8ED9CEBC67C402F229BABD18ACC3CD33C6 |
SHA-256 | BC71C8A523E0A555144DC0A1270C94FC0DFB5156D2C6BCEF5C72BAFD13AD614F |
SSDEEP | 48:CrM0Eem2syxHDk6F6QNqbov8qjx2v/qkwGcJnJ8TeZjMXhY9Kh/nop/6/LmqGvvH:CA721QMEboEqjwqkwGumRwiDmfvVx |
TLSH | T1D181830F2B51077B944241D4B34E92DAC722CAAF31BDE580389D860C2F998B6A775EE4 |
Key | Value |
---|---|
FileName | ./usr/include/gromacs/fft/fft.h |
FileSize | 16629 |
MD5 | 2C903057A2694C6E12FC6F0FC65B3880 |
SHA-1 | 1323E5E6F09E864D15C60B42AC65A134762A6456 |
SHA-256 | 8B4BA6D609F47D127CDC37B5F58743175FB3952BE540CFFABDA62D3D62A80BA6 |
SSDEEP | 192:CJ21QQmuMg4t+836PPYLwjbzvE1wIxwIFwTOdwTOKws6GFgcLCMW/j:CJ218uH2IzEXDpulLW/j |
TLSH | T1FF72640539C2922B024901B0F5DD55CE571AA07B37326499704F46382FAB9FDA6F9F8F |
Key | Value |
---|---|
FileName | ./usr/include/gromacs/mdtypes/state.h |
FileSize | 13883 |
MD5 | DE6DD6C4CBC5C01F53F112E02709C140 |
SHA-1 | 14F75CCCC5DF3CD66D97FEF5300C88330EBDBC09 |
SHA-256 | 782D970C299FEFF66F193925C8B85A87C0804D180A6D3912AAF36D1F61F9E0EE |
SSDEEP | 384:CN213u/RIFmliX1CU0lVQb1AjvMIZHqpJpCm2:i213u/RIFml+IBLm1GvMiMpv2 |
TLSH | T1D952740A5EE2437B45824265FB9D20A1D256C27F57D1A4C438AD833C0F03B6967FEBD5 |
Key | Value |
---|---|
FileName | ./usr/include/gromacs/trajectoryanalysis/cmdlinerunner.h |
FileSize | 6368 |
MD5 | AC61A718C94BA24E7B0CE18D9D0B2841 |
SHA-1 | 17A234F22876F231423303EC4136E6360D3BF832 |
SHA-256 | 73D06614DB29C4AB9BFC604A4DF1F212BF2F07FB83771912294A4CA58F4757DD |
SSDEEP | 192:Cs21QQ48WvTWHF2J5jcTJYJhqFS/CQso8AspHk:Cs21q8yWHcJCJYJGi |
TLSH | T1B6D1750A66E95327808F0EA5F64950CACE9286FF32315850747DCEBC1F246B647F6ED1 |
Key | Value |
---|---|
FileName | ./usr/include/gromacs/utility/smalloc.h |
FileSize | 16689 |
MD5 | D57ED2E7D894BCB148822C586D4F6CA4 |
SHA-1 | 1B0E1B8A5D77BBF85F8A51264510B051918997AC |
SHA-256 | 74580F445A036BBF7D123FBBE03772EB1B722E7ACE73161DEEB3C00070CDC3F7 |
SSDEEP | 384:CN21Qy9LcGjxiebreQWN7yhjT0Ni7RbN4QRN:i21jcYIevYN7yhjTj7RbNx |
TLSH | T10472735B0A845262008E47E2FF0941A69766D0BFFBB19540385F91781F1A9ED23BFF9C |
Key | Value |
---|---|
FileName | ./usr/include/gromacs/fileio/xtcio.h |
FileSize | 3353 |
MD5 | 5ECC715D8E1F36137A1F01675E14D554 |
SHA-1 | 1E11EF1E277FEE922A004A00E19A59BB734931A6 |
SHA-256 | A3DF5365C7B986D3369EF3D34B003FE21C33CB1E9DFDA2545A549A15D4769BA9 |
SSDEEP | 48:Crm0Eem2syxHDk6F6QNqbov8qjkL5bwqoFVHbs4CBpCMUY+BfnSg9:CS721QMEboEqjc5bw3bDCBlUnJSC |
TLSH | T14C61510A4568477308814BA0B64E45EB8316D2ABB5B6B080705ED76D3F065AFABF2FC4 |