DataWarrior is an open-source program for data visualization and analysis with chemical intelligence. DataWarrior combines dynamic graphical views and interactive row filtering with chemical intelligence. Scatter plots, box plots, bar charts and pie charts not only visualize numerical or category data, but also show trends of multiple scaffolds or compound substitution patterns. Chemical descriptors encode various aspects of chemical structures, e.g. the chemical graph, chemical functionality from a synthetic chemist’s point of view or 3-dimensional pharmacophore features. These allow for fundamentally different types of molecular similarity measures, which can be applied for many purposes including row filtering and the customization of graphical views. DataWarrior supports the enumeration of combinatorial libraries as the creation of evolutionary libraries. Compounds can be clustered and diverse subsets can be picked. Calculated compound similarities can be used for multidimensional scaling methods, e.g. Kohonen nets. Physicochemical properties can be calculated, structure activity relationship tables can be created and activity cliffs be visualized.
Maelezo ya mchapishaji (Kiingereza)
DataWarrior ni nini?
DataWarrior ni programu ya chanzo huria ya Windows kutoka openmolecules.org, katika kategoria ya “Sayansi na hisabati”. Imeandikwa kwa Java.
Usakinishaji na mahitaji
Kuna visakinishi rasmi kwa 64-bit katika muundo wa MSI. Kisakinishi kikuu kina ukubwa wa 170.3 MB. Usakinishaji unaomba haki za msimamizi. Kisakinishi kinaruhusu usakinishaji bila maswali (kimya). Kuna kifurushi cha MSI cha kusambaza kupitia Group Policy, Intune au Configuration Manager.
Umaarufu na aina za faili
Msimbo chanzo kwenye GitHub (thsa/datawarrior) una nyota 168. Kwenye Windows inasajili aina 6 za faili, zikiwemo .sdf, .dwam, .dwaq, .dwar na .dwas. Programu zinazofanana ni pamoja na Stellarium, KiCad na Quarto.
Maelezo ya mradi kwenye GitHub: “Interactive data analysis and visualisation with chemical intelligence”
Faida / Hasara
Faida
- Chanzo huria: mtu yeyote anaweza kukagua na kujenga msimbo
- Kifurushi cha MSI kwa usambazaji unaosimamiwa
- Usakinishaji kimya umeelezwa
Hasara
- Hakuna toleo asili la ARM64
- Usakinishaji unahitaji haki za msimamizi
- Hakuna sasisho kwa zaidi ya mwaka mmoja
Kwa ufupi: DataWarrior ni zana ya chanzo huria ya kundi la “Sayansi na hisabati” kwa kompyuta za 64-bit. Masasisho yamepungua. Wasimamizi wa mifumo wanaweza kuisambaza bila maswali.
Je, ni salama kupakua DataWarrior?
- Faili inatolewa na openmolecules.org, kikoa cha mchapishaji mwenyewe
- Kiungo cha kupakua kinatumia HTTPS
- Hashi ya SHA256 imechapishwa, hivyo unaweza kuthibitisha faili:
BD956CE41F3B72093933A00F7D1DD163E4C48518A0D13F952B3C55F58993629A· Fungua ripoti ya VirusTotal ya hashi hii - Kiungo kilijibu tulipokikagua mara ya mwisho (22 Oktoba 2026)
- Msimbo chanzo uko wazi kwa umma
- ExeAtlas haihifadhi, haifungi wala haibadilishi visakinishi
Mwongozo unaohusiana: Jinsi ya kukagua hashi ya SHA256 ya faili kwenye Windows
Matoleo ya karibuni
Toleo 1 ›| Toleo | Tarehe | Ukubwa | Faili |
|---|---|---|---|
| 6.1.0Jipya zaidi | 14 Mei 2025 | 170.3 MB | 64-bit MSI |
Kusakinisha kwa mstari wa amri
Usakinishaji kimya ›winget install --id openmolecules.DataWarrior -emsiexec /i datawarrior610.msi /qn /norestartmsiexec /x {5FCF5124-0E12-4762-87C8-48D9F5795A1E} /qn /norestartMwongozo unaohusiana: Jinsi ya kutumia winget: sakinisha na sasisha programu
Taarifa
- Mchapishaji
- openmolecules.org
- Kategoria
- Sayansi na hisabati
- Leseni
- GPL-3.0
- Bei
- Bure
- Msimbo chanzo
- github.com/thsa/datawarrior
- Imeandikwa kwa
- Java
- Inahitaji
- Windows 11 / 10
- Usanifu
- 64-bit
- Kisakinishi
- MSI
- Toleo
- 6.1.0
- Ilitolewa
- 14 Mei 2025
- Iliongezwa kwenye orodha
- 14 Mei 2025
- Matoleo yaliyoorodheshwa
- 1
- Nyota za GitHub
- 168
- Forks za GitHub
- 30
- Tovuti
- openmolecules.org
- Kitambulisho cha winget
- openmolecules.DataWarrior
- Msimbo wa bidhaa wa MSI
- {5FCF5124-0E12-4762-87C8-48D9F5795A1E}
Aina za faili inazofungua (6)
Ukadiriaji na maoni
Bado hakuna maoni. Kuwa wa kwanza kuikadiria.
Mbadala wa DataWarrior
Ona zote ›-
Chanzo huriaelfu 118 ↓ -
Chanzo huriaelfu 126.7 ↓ -
Chanzo huriaelfu 46 ↓ -
Chanzo huriaelfu 24.6 ↓ -
Chanzo huriaelfu 50.3 ↓ -
Chanzo huriaelfu 12.2 ↓ -
Chanzo huriaelfu 5.5 ↓ -
Chanzo huriaelfu 17.7 ↓
Maswali yanayoulizwa mara kwa mara
Je, DataWarrior ni bure?
Ndiyo. DataWarrior ni programu ya chanzo huria chini ya leseni ya GPL-3.0.
Je, ni salama kupakua DataWarrior?
Faili inapakuliwa kutoka openmolecules.org, ambayo ni ya mchapishaji mwenyewe; ExeAtlas haihifadhi wala haibadilishi faili. Linganisha hashi yake ya SHA256 na ile iliyoonyeshwa hapa, au fungua ripoti ya VirusTotal ya hashi hiyo.
Jinsi ya kusakinisha DataWarrior kwa winget?
Fungua PowerShell au Windows Terminal na uendeshe amri ya winget iliyoonyeshwa kwenye ukurasa huu. winget hupakua kisakinishi rasmi na kukagua hashi yake ya SHA256 kabla ya kukiendesha.
Je, DataWarrior inaweza kusakinishwa kimya?
Ndiyo. Ukurasa wa usakinishaji kimya unaonyesha amri kamili kwa kila kisakinishi, ikiwemo msiexec kwa kifurushi cha MSI.
Je, DataWarrior inafanya kazi kwenye ARM (Windows on Arm)?
Hakuna toleo la ARM64; Windows 11 on Arm inaweza kuendesha toleo la 64-bit kupitia uigaji (emulation).
Ni programu gani mbadala wa DataWarrior?
Stellarium, KiCad, Quarto, OpenChrom na Qalculate!. Ukurasa wa mbadala unazilinganisha.
