\u4e3a\u4ec0\u53d6\u540d\u4e3a\u535a\u7269\u9986\u662f\u56e0\u4e3a\u8fd9\u4e9b\u8f6f\u4ef6\u662f\u6709\u4e9b\u5386\u53f2\u4e86\uff0c\u90fd\u662f\u6211\u5e74\u8f7b\u65f6\u6536\u96c6\u7684\u5927\u7ea6\u4e00\u5343\u591a\u4e2a\u6709\u5173\u5355\u6676\u3001\u7c89\u6676\u3001\u6570\u636e\u5904\u7406\u3001\u7ed8\u56fe\u3001\u5316\u5b66\u7b49\u6676\u4f53\u5b66\u76f8\u5173\u8f6f\u4ef6\u53ca\u6e90\u4ee3\u7801\uff0c\u73b0\u6574\u7406\u51fa\u6765\u5927\u7ea6\u6709\u5341\u51e0\u4e2aG\u7684\u5bb9\u91cf\uff0c\u5927\u591a\u662f\u65e9\u671f\u4eceCCP14\u4e0a\u4e0b\u8f7d\u7684\uff0c\u73b0\u5728\u8fd9\u4e2a\u7f51\u7ad9\u5df2\u7ecf\u4e0d\u5b58\u5728\u4e86\uff08\u4f30\u8ba1\u662f\u7ad9\u957f\u8001\u5148\u751f\u53bb\u4e16\u4e86\u5c31\u6ca1\u4eba\u7ba1\u4e86\uff0c\u5728\u6b64\u5bf9\u8001\u5148\u751f\u8868\u793a\u656c\u610f\uff09\u3002\u6709\u5f88\u591a\u8f6f\u4ef6\u73b0\u5728\u4f9d\u7136\u8fd8\u5728\u4f7f\u7528\uff0c\u90e8\u5206\u8f6f\u4ef6\u5e26\u6709\u6e90\u4ee3\u7801\uff08\u5c31\u8fde\u6700\u725b\u7684Shelex93\u90fd\u6709\u6e90\u4ee3\u7801\uff09\u4e5f\u662f\u5b66\u4e60\u7684\u597d\u8d44\u6599\uff08\u5efa\u8bae\u7528\u865a\u62df\u673a\u5728Windows XP\u7cfb\u7edf\u4e0b\u8fd0\u884c\uff0c\u65b0\u7cfb\u7edf\u53ef\u80fd\u4e0d\u80fd\u8fd0\u884c\u6216\u663e\u793a\u75c5\u6bd2\uff09\u3002<\/p>\n\n\n\n
\u5148\u5217\u51fa\u76ee\u5f55\uff0c\u6162\u6162\u52a0\u94fe\u63a5<\/p>\n\n\n\n\n\n\n\n
DISK1<\/p>\n\n\n\n
\u7ed8\u56fe\u7c7b<\/p>\n\n\n\n
raswin94.zip \u7ed8\u6676\u4f53\u7ed3\u6784\u56fe\u7684\u539f\u4ee3\u7801,\u6676\u4f53\u7ed3\u6784\u7ed8\u56fe,\u5206\u5b503D\u5fae\u89c2\u7acb\u4f53\u7ed3\u6784\u7684\u8f6f\u4ef6,\u53ef\u4ee5\u65cb\u8f6c,\u4ee5\u591a\u4e2a\u6a21\u5f0f\u89c2\u770b\uff0c\u5e76\u53ef\u4ee5\u5b58\u6210\u666e\u901a\u56fe\u5f62\u6587\u4ef6\u3002<\/p>\n\n\n\n
\u6676\u4f53\u7ed8\u5236F35.ZIP \u7ed8\u5236\u6676\u4f53\u56fe\uff08f35_eng.exe f35_doc.exe)<\/p>\n\n\n\n
icmlited.exe 3\u7ef4\u5206\u5b50\u6d4f\u89c8\u5de5\u5177\uff0c\u662fMolSoft\u516c\u53f8\u51fa\u54c1\u7684\u8f6f\u4ef6ICM\u7684\u7b80\u5316\u7248,\u514d\u8d39\u63a8\u51fa\uff0c\u4f46\u529f\u80fd\u5341\u5206\u5f3a\u5927\u3002cosmoplayer21.zip \u7528WEB\u663e\u793a3D\u56fe\u7684\u63d2\u4ef6<\/p>\n\n\n\n
3D-CRYSTALS.ZIP 3D\u56fe\u5f62\u5e93\u53ca\u8bf4\u660e<\/p>\n\n\n\n
shdem60.exe \u6676\u4f53\u7ed8\u56fe<\/p>\n\n\n\n
crysconI.exe \u7528\u539f\u5b50\u5750\u6807\u753b\u7c89\u672b\u56fe<\/p>\n\n\n\n
vmd16.exe \u5206\u5b50\u7ed8\u56fe\uff08\u539f\u4ee3\u7801vmd16sr.zip vmd-1.6.src.tar.gz\uff09<\/p>\n\n\n\n
acdcs10.exe \u4e8c\u7ef4\u5206\u5b50\u7ed3\u6784\u7ed8\u56fe\u7a0b\u5e8f\u3002…<\/p>\n\n\n\n
PWCgraph.exe Crystallographica \u6839\u636e\u539f\u5b50\u5750\u6807\u7ed8\u6676\u4f53\u56fe\u3001\u7c89\u672b\u56fe\u7b49\uff0c\u5e76\u5bf9\u5176\u95f4\u7684\u5173\u7cfb\u8fdb\u884c\u5206\u6790\uff08PASCL\u65b9\u5f0f\u8f93\u5165\uff09(Crystallographica v1.6 : Name: Team UCF s\/n: 1234567890 Licenses: 9999 Normal: TRWAAH YHHJIR Student: MWYATPPUHJIR Opal: ABWWKBUVHJIR Lite: CGZNLWITHJIR Teaching: TJSEM VVBHJIR)<\/p>\n\n\n\n
PWExPack.exe Crystallographica\u670d\u52a1\u5305<\/p>\n\n\n\n
STRUPLO for Windows (version 1.0) \u6676\u4f53\u7ed3\u6784\u7ed8\u56fe<\/p>\n\n\n\n
Ortep-3 \u7ed8\u70ed\u632f\u52a8\u692d\u5706\u56fe<\/p>\n\n\n\n
DTMM40 \u662f\u4e00\u4e2a\u7b80\u5355\u6613\u7528\u7684(\u6709\u673a\uff093\u7ef4\u5206\u5b50\u6a21\u578b\u663e\u793a\u3001\u7f16\u8f91\u4e0e\u6784\u5efa\u7a0b\u5e8f\uff0c\u53ef\u4ee5\u4ee5\u5404\u79cd\u6a21\u5f0f\u663e\u793a3\u7ef4\u5206\u5b50\u3002dm2demo.exe \u7ed8\u6676\u4f53\u7ed3\u6784\u56fe\u7684DEMO<\/p>\n\n\n\n
crystal96.zip \u7528\u6676\u4f53\u7ed3\u6784\u6570\u636e\u751f\u6210POV\u548cVRML\u6587\u4ef6<\/p>\n\n\n\n
DRAWv24.zip \u7528\u6676\u4f53\u7ed3\u6784\u6570\u636e\uff08ATOM\u6587\u4ef6\uff09\u751f\u4ea7POV\u548cVRML\u6587\u4ef6\u7684\u539f\u4ee3\u7801<\/p>\n\n\n\n
ch20w32.exe IE\u4e0eNetScape\u6d4f\u89c8\u5668\u63d2\u4ef6,\u5b89\u88c5\u540e,\u53ef\u4ee5\u76f4\u63a5\u7528\u6d4f\u89c8\u5668\u89c2\u770bPDB\u683c\u5f0f\u7684\u6587\u4ef6,\u76f4\u63a5\u5728\u6d4f\u89c8\u5668\u4e2d\u89c2\u770b3D\u5206\u5b50\u3002<\/p>\n\n\n\n
WLViewerLite35.exe 3\u7ef4\u5206\u5b50\u6d4f\u89c8\u5de5\u5177\uff0c\u662f\u5206\u5b50\u6a21\u62df\u516c\u53f8\u51fa\u54c1\u7684\u8f6f\u4ef6Weblab ViewPro\u7684\u7b80\u5316\u7248,\u514d\u8d39\u63a8\u51fa\uff0c\u4f46\u529f\u80fd\u4e5f\u5341\u5206\u5f3a\u5927\u3002\u53ef\u8bfb\u53d6PDB\u683c\u5f0f\u53ca\u5176\u4ed6\u6570\u79cd\u683c\u5f0f\u7684\u5206\u5b50\u6587\u4ef6<\/p>\n\n\n\n
ATOMWIN40 atoms \u4e2d\u6587\u6c49\u5316\u7248<\/p>\n\n\n\n
\u7ed3\u6784\u5206\u6790\u4e0e\u89e3\u6790<\/p>\n\n\n\n
\u6676\u4f53\u7ed3\u6784\u6d4b\u5b9a\u8f6f\u4ef6\u5305(zaoscail.exe)\u4e00\u5957\u5305\u542b\u4e86\u4ee5\u4e0b\u5168\u90e8\u89e3\u7ed3\u6784\u7a0b\u5e8f\u7684\u7a0b\u5e8f\u5305\uff0cABSEN, GETSPG, GENINS, SHELXS-86, SHELXS-97, SHELXL-97-2,<\/p>\n\n\n\n
ORTEX, CIFTAB, RASTEP and RENDER, FORMATS, Powdis, Powutl<\/p>\n\n\n\n
Ciftab and Psicalc.\u975e\u5e38\u8d85\u503c\u3002<\/p>\n\n\n\n
zaoscail.exe \u6676\u4f53\u7ed3\u6784\u6d4b\u5b9a\u8f6f\u4ef6\u5305<\/p>\n\n\n\n
wcromer.zip \u8ba1\u7b97\u6563\u5c04\u56e0\u5b50<\/p>\n\n\n\n
zthma32.zip \u70ed\u632f\u52a8\u5206\u6790<\/p>\n\n\n\n
laue.zip \u6839\u636eHKL\u786e\u5b9a\u7a7a\u95f4\u7fa4<\/p>\n\n\n\n
setup-beta1-dec00.exe\uff08crystals.exe\uff09\u81ea\u52a8\u6676\u4f53\u7ed3\u6784\u6d4b\u5b9a\u53ca\u5206\u6790\u8f6f\u4ef6\uff08\u5f88\u597d\u7528\uff09<\/p>\n\n\n\n
Cizip.zip CrystInfo 1.0\u662f\u4e00\u4e2aWindows\u5e94\u7528\u7a0b\u5e8f\uff0c\u7528\u6765\u5feb\u901f\u3001\u5bb9\u6613\u5730\u6784\u5efa\u3001\u89c2\u5bdf\u4e0e\u68c0\u67e5\u6676\u4f53\u7ed3\u6784\u3002\u6676\u4f53\u7684\u4efb\u4f55\u53c2\u6570\u53ef\u4ee5\u968f\u610f\u8c03\u6574\uff0c\u53ef\u4ee5\u6539\u53d8\u6676\u4f53\u5185\u5355\u4e2a\u539f\u5b50\u3001\u539f\u5b50\u7c7b\u578b\u4e0e\u952e\u578b\uff0c\u5e76\u53ef\u4ee5\u6539\u53d8\u6676\u4f53\u81ea\u8eab\u7684\u7a7a\u95f4\u7fa4\u4f53\u4e0e\u5355\u4f4d\u6676\u683c\u7684\u53c2\u6570\u3002<\/p>\n\n\n\n
caos.zip \u6676\u4f53\u7ed3\u6784\u6d4b\u5b9a\u64cd\u4f5c\u7cfb\u7edf<\/p>\n\n\n\n
dirdif99.zip WINDOWS\u7248\u7684\u89e3\u7ed3\u6784\u7a0b\u5e8f\uff0cDIRDIF for Windows is a set of MS-Windows programs for so lving crystal structures. Major features are the use of Patterson methods, and special direct methods for s olving symmetry problems. Powerful procedures are provided for the use of chemical knowledge to solve difficult structures. Ab-initio direct methods and structure refinement are not included in the DIRDIF pac kage.<\/p>\n\n\n\n
cif2sx.zip \u6570\u636e\u8f6c\u6362Program CIF2SX will take as input a legal CIF file and output a legal SHELXL93 i nstruction file.<\/p>\n\n\n\n
wgx_164.zip WinGX \u7ed3\u6784\u5206\u6790\u7a0b\u5e8fis a MS-Windows system of programs for solving, refining and analy sing single crystal X-ray diffraction data for small molecules. It provides a consistent and user-friendly G UI for some of the best publically available crystallographic programs, and has interfaces to other popular programs such as SHELXL-97 and SIR-97.<\/p>\n\n\n\n
PLATON \u548cSHELX97\u4e00\u6837\u7684\u6676\u4f53\u7ed3\u6784\u5206\u6790\u5de5\u5177\u3002is a versatile SHELX97 compatible crystallographic tool implementing\u3002It is a versatile crystallographic tool implementing a large variety of standard geometrica l calculations (i.e. bonds, angles, torsions, planes, rings, inter-molecular contacts (H-Bond analysis), Coordi nation etc), tests (i.e. for missing symmetry, voids in the lattice etc.), utilities (cell transformation, SHEL XL input etc.), graphics (e.g automatic labelled ‘ORTEP-lookalike plots and the molecular graphics progra m PLUTON) and several filters (e.g. the DIFABS technique for empirical absorption correction (Walker & Stuart),<\/p>\n\n\n\n
pwt.zip PLATON \u7684WINDOWS TASKBAR<\/p>\n\n\n\n
structures by a Rietveld-type refinement of the atomic coordinates and cell parameters taken from a starti ng crystalline model.<\/p>\n\n\n\n
pc-gsas.exe gsas \u5355\u6676\u3001\u7c89\u672b\u7ed3\u7ed3\u6784\u8f6f\u4ef6\u754c\u9762<\/p>\n\n\n\n
gsaskit.exe gsas \u5de5\u5177<\/p>\n\n\n\n
axesw23.exe AXE \u5355\u6676\u7ed3\u6784\u8f6f\u4ef6<\/p>\n\n\n\n
espoir.zip<\/p>\n\n\n\n
fprime.zip<\/p>\n\n\n\n
class.zip RIETVELD \u6676\u4f53\u7ed3\u6784\u7cbe\u4fee\u7a0b\u5e8f<\/p>\n\n\n\n
Volcal.zip \u591a\u9762\u4f53\u4f53\u79ef\u548c\u626d\u66f2\u53c2\u6570\u8ba1\u7b97\u7a0b\u5e8f<\/p>\n\n\n\n
calvalen.zip<\/p>\n\n\n\n
Diffuse-4.1b-win32.exe<\/p>\n\n\n\n
gpt35doc.zip<\/p>\n\n\n\n
hklextin.zip<\/p>\n\n\n\n
IkaGus_02.exe<\/p>\n\n\n\n
ster1_12.zip \u5206\u5b50\u952e\u8ba1\u7b97<\/p>\n\n\n\n
TOPOSdemo.exe<\/p>\n\n\n\n
GOPENMOL \u662f\u4e00\u4e2a\u663e\u793a\u5e76\u5206\u6790\u5206\u5b50\u7ed3\u6784\u53ca\u5176\u7279\u6027\uff0c\u8ba1\u7b97\u5206\u5b50\u8f68\u9053\u3001\u7535\u5b50\u52bf\u7684\u8f6f\u4ef6\u5305\uff0c\u652f\u6301\u591a\u79cd\u5206\u5b50\u7ed3\u6784\u683c\u5f0f\uff0c<\/p>\n\n\n\n
TINKER \u4e3aDOS\u4e0b\u7684\u5206\u5b50\u8bbe\u8ba1\u5efa\u6a21\u8f6f\u4ef6\uff0c\u53ef\u4f7f\u7528\u8bb8\u591a\u5e38\u7528\u53c2\u6570\u96c6\uff0c<\/p>\n\n\n\n
PWQikCIF.exe CIF\u67e5\u8be2\u8f6f\u4ef6<\/p>\n\n\n\n
zmoilin.exe \u5206\u5b50\u6784\u5efa\u4e0e\u89c2\u5bdf\u8f6f\u4ef6\uff0c\u662fTinker\u8f6f\u4ef6\u7684Windows\u754c\u9762\u7a0b\u5e8f<\/p>\n\n\n\n
dtmm4setup.exe \u662f\u4e00\u4e2a\u7b80\u5355\u6613\u7528\u76843\u7ef4\u5206\u5b50\u6a21\u578b\u663e\u793a\u3001\u7f16\u8f91\u4e0e\u6784\u5efa\u7a0b\u5e8f\uff0c\u53ef\u4ee5\u4ee5\u5404\u79cd\u6a21\u5f0f\u663e\u793a3\u7ef4\u5206\u5b50\uff0c\u5e76\u80fd\u8fdb\u884c\u7f16\u8f91\u3002\u672c\u7248\u672c\u4e3a\u65f6\u95f4\u9650\u5236\u7248\uff0c\u53ea\u53ef\u57282000\u5e74\u5185\u4f7f\u7528\u3002<\/p>\n\n\n\n
gopenmol.win32.1.4.zip \u4e00\u4e2a\u663e\u793a\u5e76\u5206\u6790\u5206\u5b50\u7ed3\u6784\u53ca\u5176\u7279\u6027\uff0c\u8ba1\u7b97\u5206\u5b50\u8f68\u9053\u3001\u7535\u5b50\u52bf\u7684\u8f6f\u4ef6\u5305<\/p>\n\n\n\n
icmlited.exe 3\u7ef4\u5206\u5b50\u6d4f\u89c8\u5de5\u5177\uff0c\u662fMolSoft\u516c\u53f8\u51fa\u54c1\u7684\u8f6f\u4ef6ICM\u7684\u7b80\u5316\u7248,\u514d\u8d39\u63a8\u51fa\uff0c\u4f46\u529f\u80fd\u5341\u5206\u5f3a\u5927\u3002\u53ef\u8bfb\u53d6PDB\u683c\u5f0f\u53ca\u5176\u4ed6\u6570\u79cd\u683c\u5f0f\u7684\u5206\u5b50\u6587\u4ef6<\/p>\n\n\n\n
java3d-1_2-win.exe \u4f7f\u7528JAVA\u6280\u672f\u7f16\u5199\u7684\u4e09\u7ef4\u5206\u5b50\u67e5\u770b\u5668\uff0c\u9700\u8981\u5b89\u88c5Java3D\uff0c2.1M\uff0c\u540e\u624d\u80fd\u6267\u884c\uff0c\u6b64\u7248\u672c\u4f7f\u7528\u6d4f\u89c8\u5668\u6267\u884c<\/p>\n\n\n\n
m2m34dem.exe \u4e3b\u8981\u7528\u6765\u8fdb\u884c\u5404\u79cd\u5206\u5b50\u6587\u4ef6\u7684\u8f6c\u6362\uff0c\u652f\u630130\u79cd\u4e3b\u8981\u5206\u5b50\u683c\u5f0f\uff0c\u4e5f\u53ef\u4ee5\u7528\u6765\u8fdb\u884c3\u7ef4\u5206\u5b50\u7684\u7b80\u5355\u663e\u793a\u3002\u53ef\u5c06PDB\u683c\u5f0f\u8f93\u51fa\u4e3aPOV\u683c\u5f0f\u540e\uff0c\u7528POV-RAY\u8fdb\u884c\u6e32\u67d3\uff0c\u751f\u6210\u975e\u5e38\u6f02\u4eae\u7684\u4e09\u7ef4\u56fe\u5f62\u3002\u6f14\u793a\u7248\u53ea\u652f\u6301\u6837\u677f\u6587\u4ef6\u4e0e\u539f\u5b50\u6570\u5c0f\u4e8e20\u7684\u5206\u5b50\u6587\u4ef6\u683c\u5f0f\u7684\u8f6c\u6362\u3002<\/p>\n\n\n\n
Mage_5_75.exe \u8bfb\u53d6\u5e76\u6f14\u793aKinemage\u683c\u5f0f\u6587\u4ef6\u7684\u4e13\u7528\u8f6f\u4ef6\u3002Kinemage\u683c\u5f0f\u662f\u4e00\u79cd\u7535\u8111\u56fe\u50cf\u4ea4\u4e92\u5f0f\u6f14\u793a\u683c\u5f0f<\/p>\n\n\n\n
MP2install.exe MolPOV\u662fPDB\u683c\u5f0f\u81f3POV\u683c\u5f0f\u8f6c\u5316\u5de5\u5177\uff0c\u53ef\u4ee5\u5c06\u5927\u5206\u5b50PDB\u683c\u5f0f\u6587\u4ef6\u8f6c\u5316\u4e3aPOV\u683c\u5f0f<\/p>\n\n\n\n
———————————————————————————————————————————– DISK2<\/p>\n\n\n\n
\u7c89\u672b\u884d\u5c04\u8f6f\u4ef6<\/p>\n\n\n\n
pcw23.exe \u6839\u636e\u7ed3\u6784\u7ed8\u7c89\u672b\u56fe\uff0c\u8ba1\u7b97\u6676\u7c92\u5ea6\u548c\u7578\u53d8\uff0c\u6676\u80de\u53c2\u6570\u7cbe\u4fee\uff0c\u7ed3\u6784\u5c1d\u8bd5\uff08\u5f88\u597d\u7528\uff09<\/p>\n\n\n\n
powder2.zip\uff08powder1.zip\uff09\u6676\u80de\u53c2\u6570\u8ba1\u7b97\uff0c\u6307\u6807\u5316<\/p>\n\n\n\n
wincell.zip \u96f6\u70b9\u6821\u6b63\u3001\u6676\u80de\u53c2\u6570\u7cbe\u6d4b\u3001\u6839\u636e\u6676\u80de\u53c2\u6570\u8ba1\u7b97\u6307\u6807<\/p>\n\n\n\n
chekcell.zip \u6676\u80de\u53c2\u6570\u8ba1\u7b97\uff0c\u5bf9\u79f0\u6d4b\u8bd5<\/p>\n\n\n\n
celref.zip \u7cbe\u6d4b\u6676\u80de\u53c2\u6570(\u4e0echekcell.zip\u76f8\u540c\uff0c\u529f\u80fd\u66f4\u5f3a\uff09<\/p>\n\n\n\n
UnitCell.zip \u6676\u80de\u53c2\u6570\u8ba1\u7b97<\/p>\n\n\n\n
Xrayscan.zip \u6307\u6807\u5316\u7a0b\u5e8f\uff08DOS\uff09<\/p>\n\n\n\n
relatedwin32.zip \u6307\u6807\u5316\u7a0b\u5e8f\uff08DOS\uff09<\/p>\n\n\n\n
crysinst.exe \u6307\u6807\u5316\u8f6f\u4ef6\u5305\uff08DICVOL\uff0cITO\uff0cTREOR90\uff09<\/p>\n\n\n\n
indx.zip \u6839\u636e\u6676\u80de\u53c2\u6570\u3001\u7a7a\u95f4\u7fa4\u8ba1\u7b97\u6307\u6807<\/p>\n\n\n\n
poudrix.zip \u6839\u636e\u539f\u5b50\u5750\u6807\u8ba1\u7b97\u7c89\u672b\u56fe<\/p>\n\n\n\n
index.zip \u672a\u77e5\u6676\u80de\u7684\u7c89\u672b\u6cd5\u6307\u6807\u5316<\/p>\n\n\n\n
Pulwin1.zip \u56fe\u8c31\u62df\u5408<\/p>\n\n\n\n
gemstone.zip \u5b9d\u77f3\u9274\u5b9a<\/p>\n\n\n\n
pearson.xls EXCEL\u7684\u8c31\u7ebf\u62df\u5408\uff08\u53ef\u4ee5\u7528\u4e8e\u5206\u6790\u62df\u5408\u65b9\u6cd5\uff09<\/p>\n\n\n\n
derb.zip \u7c89\u672bPDF\u6570\u636e\u5206\u6790\uff08\u539f\u4ee3\u7801\uff09<\/p>\n\n\n\n
PXALL.zip POWDER5<\/p>\n\n\n\n
rietan94.exe Rietveld\u7cbe\u4fee\u8f6f\u4ef6\uff0c94\u7248\u5e26\u539f\u4ee3\u7801<\/p>\n\n\n\n
wgetspec.zip \u67e5\u7a7a\u95f4\u7fa4\u7684\u5bf9\u79f0\u5750\u6807<\/p>\n\n\n\n
equiv.zip \u67e5\u627e\u7a7a\u95f4\u7fa4\u7684\u5bf9\u79f0\u5750\u6807\uff08\u4e0ewgetspec.zip\u76f8\u4f3c\uff09<\/p>\n\n\n\n
wulff.zip \u753b\u8d64\u5e73\u6295\u5f71\u5706<\/p>\n\n\n\n
truecell.zip \u590d\u5408\u6676\u80de\u67e5\u627e<\/p>\n\n\n\n
lepage.zip \u683c\u5b50\u8f6c\u6362<\/p>\n\n\n\n
dispano.zip \u6563\u5c04\u56e0\u5b50F\u7cfb\u6570\u67e5\u627e<\/p>\n\n\n\n
convert301.zip \u6587\u4ef6\u8f6c\u5316<\/p>\n\n\n\n
orientex.zip \u52b3\u6328\u6cd5\u6676\u4f53\u5b9a\u5411<\/p>\n\n\n\n
scatfac.zip \u8ba1\u7b97\u539f\u5b50\u6563\u5c04\u56e0\u5b50<\/p>\n\n\n\n
gretep.zip \u7ed8\u70ed\u632f\u52a8\u53c2\u6570\u56fe<\/p>\n\n\n\n
overlap.zip \u63d0\u53d6\u5408\u6cd5\u7ed3\u6784\u56e0\u5b50\u5cf0<\/p>\n\n\n\n
getspec.zip \u8ba1\u7b97\u5bf9\u79f0\u64cd\u4f5c<\/p>\n\n\n\n
gfour.zip \u5085\u7acb\u53f6\u8ba1\u7b97(\u53ef\u4e0eFULLPROF\u8fde\u7528\uff09<\/p>\n\n\n\n
winplotr.zip FULLPROF\u8f6f\u4ef6\u5305(\u662fwinfp98\u76842001\u65b0\u7248\u672c\uff09<\/p>\n\n\n\n
valence.exe \u952e\u4ef7\u8ba1\u7b97<\/p>\n\n\n\n
getspec.for \u8ba1\u7b97\u5bf9\u79f0\u64cd\u4f5c<\/p>\n\n\n\n
gtsplb.for \u8ba1\u7b97\u7279\u5b9a\u4f4d\u7f6e\u8868<\/p>\n\n\n\n
coue.zip a program that converts Crystal atomic constraints<\/p>\n\n\n\n
into GSAS constraints in a forn that can be<\/p>\n\n\n\n
cut and pasted into the GSAS atom menu in EXPEDT.<\/p>\n\n\n\n
rietan2000.zip \u7c89\u6676\u5168\u8c31\u62df\u5408\u6676\u80de\u53c2\u6570\u7cbe\u4feeRIETAN-2000 is a multi-purpose pattern-fitting system<\/p>\n\n\n\n
drxwin2.2.45_demo.zip \u7c89\u6676\u56fe\u5f62\u5904\u7406\u5bfb\u5cf0\u3001\u62df\u5408\u7b49DRXWIN Windows-based graphical and Analytical To ols for XRD Powder Patterns. Works with files from several diffractometers.<\/p>\n\n\n\n
powder18.zip \u7c89\u672b\u62df\u5408\u8f6f\u4ef6dos<\/p>\n\n\n\n
rietq23.zip \u7c89\u672b\u62df\u5408\uff0c\u7ed3\u6784\u7cbe\u4fee\u7a0b\u5e8f\uff08windows\uff09<\/p>\n\n\n\n
diffuse.zip \u7c89\u672b\u62df\u5408\u539f\u4ee3\u7801\uff08for\uff09<\/p>\n\n\n\n
ARITVE is \u7c89\u672b\u6cd5\u8fdb\u884c\u7ed3\u6784\u548c\u6676\u80de\u53c2\u6570\u7cbe\u4feea program for modelling amorphous<\/p>\n\n\n\n
WinMProf.exe \u7c89\u672b\u6cd5\u7ed3\u6784\u7cbe\u4fee\u7a0b\u5e8fRietveld profile refinement program<\/p>\n\n\n\n
janainst_new_pentium.zip jana2000 \u7528\u7c89\u672b\u6570\u636e\u89e3\u7ed3\u6784\u548c\u7cbe\u4fee\u7ed3\u6784\u7a0b\u5e8f<\/p>\n\n\n\n
k-inst8.zip \u7c89\u672b\u8c31\u7ebf\u62df\u5408An interactive and graphical X-ray line profile fitting program XFIT tracdemo.exe \u7c89\u672b\u56fe\u5904\u7406\uff0c\u5bfb\u5cf0\u3001\u6307\u6807\u5316\u3001\u6676\u80de\u53c2\u6570\u7cbe\u4fee\u3001\u6676\u7c92\u5ea6\u53ca\u5b9a\u91cf\u5206\u6790<\/p>\n\n\n\n
winfit.zip x\u5c04\u7ebf\u56fe\u8c31\u7ebf\u62df\u5408\uff0c\u6676\u7c92\u5ea6\u3001\u6676\u683c\u7578\u53d8\u5206\u6790\u8f6f\u4ef6package for complete profile-analysis of x-ray r eflections<\/p>\n\n\n\n
renexe.zip \u7f16\u8f91\u5206\u6790\u884d\u5c04\u56fe\uff08\u62df\u5408\u7b49\uff0c\u7528\u4e8e\u5206\u6790\u5cf0\u5f62\u8f83\u5f25\u6563\u7684\u884d\u5c04\u56fe\uff09Renex is diffraction patterns editor and analyser for Windows.It has been specifically designed to works with overlapped peaks and “non-idea l” or “noisy” patterns. X-ray diffraction data.<\/p>\n\n\n\n
hklgen.zip \u6839\u636e\u6676\u80de\u53c2\u6570\u751f\u6210HKL\u6307\u6807<\/p>\n\n\n\n
sginfo_1_01.zip \u7a7a\u95f4\u7fa4\u4fe1\u606f<\/p>\n\n\n\n
winfp98.zip \u591a\u76f8\u5168\u8c31\u62df\u5408\uff0c\u7ed3\u6784\u7cbe\u4fee\u3001\u5b9a\u91cf\u5206\u6790<\/p>\n\n\n\n
ConvX.exe \u6587\u4ef6\u683c\u5f0f\u8f6c\u6362<\/p>\n\n\n\n
xry96dos.zip DOS\u7684\u7c89\u672b\u6cd5\u7ed3\u6784\u7cbe\u4fee\u7a0b\u5e8f<\/p>\n\n\n\n
zefsaII99.zip \u7c89\u672b\u6cd5\u7ed3\u6784\u6d4b\u5b9a\u7a0b\u5e8f\uff08C\u539f\u4ee3\u7801\uff09<\/p>\n\n\n\n
SWS.zip \u4e00\u7ec4DOS\u7a0b\u5e8f\uff08\u5305\u62ec\u5bf9\u79f0\u7fa4\u6295\u70b9\uff0c\u7b49\u6548\u70b9\u5bf9\u79f0\uff0c\u70b9\u7fa4\u6676\u9762\uff0c\u5143\u7d20\u5468\u671f\u8868\uff0c\u884d\u5c04\u4eff\u771f\uff0c2D\u7ed8\u56fe\uff0c<\/p>\n\n\n\n
\u8d64\u5e73\u6295\u5f71\uff0c\u5085\u7acb\u53f6\u53d8\u6362\u6f14\u793a\uff0c\u6676\u4f53\u4e60\u6027\u56fe\uff0c\u6676\u4f53\u7ed3\u6784\u56fe\uff0cRietveld \u4eff\u771f\u56fe\uff0c\u5e73\u9762\u7fa4\uff0c\u52b3\u57c3\u884d\u5c04\u4eff\u771f\u7b4916\u4e2a\u7a0b\u5e8f\uff0c\u542b\u8bf4\u660e\uff09<\/p>\n\n\n\n
Maud.zip Maudgl.zip updateMaud.zip \u884d\u5c04\u8c31\u62df\u5408\u5206\u6790<\/p>\n\n\n\n
babel94.zip \u6587\u4ef6\u8f6c\u6362\u3001\u67e5\u627eProgram designed to interconvert a number of file formats currently used in molecular moldeling. rpm for Linux available at ftp site.<\/p>\n\n\n\n
Db2di.zip db\u8ba1\u7b97\uff08dos\uff09<\/p>\n\n\n\n
Db9807a2.zip DB\u7c89\u672b\u6cd5\u8f6f\u4ef6\uff08DOS\uff09<\/p>\n\n\n\n
Dmplot3.48.zip BD9411\u7c89\u672b\u7ed8\u56fe<\/p>\n\n\n\n
kriber_1.0.zip \u8ba1\u7b97\u952e\u957f\u952e\u89d2\u7684\u539f\u4ee3\u7801<\/p>\n\n\n\n
ensetup.exe \u7c89\u672b\u6cd5\u89e3\u7ed3\u6784\uff08DEMO\uff09<\/p>\n\n\n\n
farhan.zip \u5b9a\u6027\u5b9a\u91cf\u5206\u6790(dos)<\/p>\n\n\n\n
qfact.zip \u7c98\u571f001\u884d\u5c04\u5bbd\u5316\u56e0\u5b50<\/p>\n\n\n\n
theta.zip 2o-d\u503c\u8f6c\u6362<\/p>\n\n\n\n
lpdfdemo.exe (lookPDF)\u67e5PDF\u5361\u7247<\/p>\n\n\n\n
zpowder.exe \u7ed3\u6784\u7cbe\u4fee\u7a0b\u5e8f<\/p>\n\n\n\n
Diffuse-4.0-beta.exe \u7ed3\u6784\u7cbe\u4fee\u5168\u8c31\u62df\u5408\u7ed8\u56fe\u8f6f\u4ef6\u5305\uff08dos\uff09<\/p>\n\n\n\n
bgmnwin32.zip \u89e3\u7ed3\u6784\u7a0b\u5e8f\uff08dos demo)<\/p>\n\n\n\n
crossbed.zip \u6d4b\u91cf\u5c42\u65cb\u8f6c\u5ea6<\/p>\n\n\n\n
struct.zip \u8ba1\u7b97001\u7ed3\u6784\u56e0\u5b50<\/p>\n\n\n\n
superlat.zip \u53cd\u5c04\u66f2\u7ebf\u8ba1\u7b97<\/p>\n\n\n\n
x-ray.zip \u53c8\u662f\u4e00\u4e2a\u53cd\u5c04\u66f2\u7ebf\u8ba1\u7b97<\/p>\n\n\n\n
txrddemo.zip PDF\u67e5\u627e\u7a0b\u5e8f\uff08DEMO\u7248\uff09<\/p>\n\n\n\n
db9411.zip windows\u754c\u9762\u7684Rietveld\u7a0b\u5e8f<\/p>\n\n\n\n
——————————————————————————————————<\/p>\n\n\n\n
DISK3<\/p>\n\n\n\n
C\u539f\u4ee3\u7801<\/p>\n\n\n\n
diff.zip \u62df\u5408c\u539f\u4ee3\u7801<\/p>\n\n\n\n
gnuplot.zip \u66f2\u7ebf\u7ed8\u56fe<\/p>\n\n\n\n
gpcontrib.zip \u6570\u636e\u62df\u5408\u7ed8\u56fe\u51fd\u6570\u5e93<\/p>\n\n\n\n
raswin-94 \u7ed83d\u7ed3\u6784\u56fe<\/p>\n\n\n\n
graph.zip \u7ed8\u56fec\u539f\u4ee3\u7801<\/p>\n\n\n\n
viewtools.zip 3d\u56fe\u5f62\u7684\u89c2\u770b\u548c\u6253\u5370<\/p>\n\n\n\n
xnd118.zip \u591a\u76f8\u7c89\u672b\u6cd5\u6676\u4f53\u7ed3\u6784\u7cbe\u4fee1.18<\/p>\n\n\n\n
xnd120.zip \u591a\u76f8\u7c89\u672b\u6cd5\u6676\u4f53\u7ed3\u6784\u7cbe\u4fee1.20<\/p>\n\n\n\n
xnd_1.zip \u591a\u76f8\u7c89\u672b\u6cd5\u6676\u4f53\u7ed3\u6784\u7cbe\u4fee1.0<\/p>\n\n\n\n
xnd95.zip \u591a\u76f8\u7c89\u672b\u6cd5\u6676\u4f53\u7ed3\u6784\u7cbe\u4feewin95<\/p>\n\n\n\n
atominfo96.zip \u539f\u5b50\u6563\u5c04\u56e0\u5b50<\/p>\n\n\n\n
crystal96.zip \u6676\u4f53\u7ed3\u6784\u7ed8\u56fe\uff08\u7403\u3001\u952e\u3001\u591a\u9762\u4f53\uff09\u5e76\u751f\u6210VRML\u6587\u4ef6<\/p>\n\n\n\n
DRAWv24.zip \u5c06\u6676\u4f53\u7ed3\u6784\u6587\u4ef6\u751f\u6210VRML\u6587\u4ef6<\/p>\n\n\n\n
drawxtl96.zip \u751f\u6210POV\u548cVRML\u6587\u4ef6<\/p>\n\n\n\n
cc3d_src,lib,doc VRML\u67e5\u770b\u539f\u4ee3\u7801<\/p>\n\n\n\n
sourc106.zip \u6676\u4f53\u7ed3\u6784\u7ed8\u56fe<\/p>\n\n\n\n
vmd16sr.zip 3d\u7ed8\u56fe\u539f\u4ee3\u7801<\/p>\n\n\n\n
wcromer.zip \u8ba1\u7b97f’ f”\u56e0\u5b50\u7684\u539f\u4ee3\u7801<\/p>\n\n\n\n
csize.c \u6676\u7c92\u5ea6\u8ba1\u7b97<\/p>\n\n\n\n
zefsaII99.zip \u6cb8\u77f3\u7ed3\u6784\u5206\u6790\u7a0b\u5e8f<\/p>\n\n\n\n
atoms.zip \u86cb\u767d\u7ed3\u6784\u663e\u793a\u539f\u4ee3\u7801c\u8bed\u8a00<\/p>\n\n\n\n
gcube2plt.c \u7acb\u65b9\u9ad8\u65af\u7b97\u6cd5<\/p>\n\n\n\n
babel-94<\/p>\n\n\n\n
mm2_params.c<\/p>\n\n\n\n
mmconv.zip<\/p>\n\n\n\n
moldy.zip \u5206\u5b50\u52a8\u529b\u5b66\u4eff\u771f\u7a0b\u5e8f<\/p>\n\n\n\n
multi.zip<\/p>\n\n\n\n
Raster3D_2.4b.zip \u7ed83d\u5206\u5b50\u56fe<\/p>\n\n\n\n
rayshade.4.0.zip \u5c04\u7ebf\u8ddf\u8e2a\u7a0b\u5e8f<\/p>\n\n\n\n
react.zip \u5316\u5b66\u53cd\u5e94\u52a8\u529b\u6a21\u62df\u7a0b\u5e8f<\/p>\n\n\n\n
react2.zip<\/p>\n\n\n\n
reg_sub.zip \u7531\u5206\u5b50\u632f\u52a8\u4ea7\u751fxyz<\/p>\n\n\n\n
sginfo96.zip \u7a7a\u95f4\u7fa4\u4fe1\u606f\u8868<\/p>\n\n\n\n
simpro.zip \u62df\u5408\u7a0b\u5e8f<\/p>\n\n\n\n
simref1.zip<\/p>\n\n\n\n
Espoir.zip Espoir \u5206\u5b50\u56fe\u5f62\u7ed8\u56fe\u5305MS Visual C++ 6 Compaq Visual Fortran 6.1 spectrum.c \u4ea7\u751f\u5149\u8c31\u9891\u7387\u548c\u632f\u5e45<\/p>\n\n\n\n
steric.zip \u5206\u5b50\u53c2\u6570\u8ba1\u7b97\u914d\u4f4d\u952e\u89d2\u7b49<\/p>\n\n\n\n
translit.zip<\/p>\n\n\n\n
vaxtostd.c<\/p>\n\n\n\n
nab5.zip \u521b\u5efa\u63cf\u8ff0\u9ad8\u5206\u5b50\u6838\u9178<\/p>\n\n\n\n
nab5_v10.zip \u521b\u5efa\u63cf\u8ff0\u9ad8\u5206\u5b50\u6838\u91781.0<\/p>\n\n\n\n
nab5_v11.zip \u521b\u5efa\u63cf\u8ff0\u9ad8\u5206\u5b50\u6838\u91781.1<\/p>\n\n\n\n
otf.zip \u9ad8\u5206\u5b50\u7ed8\u56fe\u7a0b\u5e8f<\/p>\n\n\n\n
otf-0.2.zip \u9ad8\u5206\u5b50\u7ed8\u56fe\u7a0b\u5e8f0.2<\/p>\n\n\n\n
viewmol-2.2.1.zip \u86cb\u767d\u5206\u5b50\u7ed8\u56fe<\/p>\n\n\n\n
periodic.zip<\/p>\n\n\n\n
visad1_1.zip \u4ea4\u4e92\u5f0f\u8fd0\u7b97\u7cfb\u7edf<\/p>\n\n\n\n
cod14src.exe \u81ea\u52a8\u4ee3\u7801\u751f\u6210\u5668<\/p>\n\n\n\n
quatfit.c \u56db\u5143\u7d20\u6cd5\u6dfb\u52a0\u539f\u5b50\u62df\u5408<\/p>\n\n\n\n
mmio.zip \u5b8f\u6a21\u578b\u7ed3\u6784\u8f93\u5165\u8f93\u51faMMIO stands for “MacroModel Input-Output” documentation.zip ps \u5b8f\u4ee3\u7801<\/p>\n\n\n\n
dsql.3.zip \u5206\u5e03\u5f0fSQL C\u539f\u4ee3\u7801<\/p>\n\n\n\n
dynal.zip \u7a97\u4f53\u5e93<\/p>\n\n\n\n
fda.zip fda \u8f93\u5165\u7a0b\u5e8f<\/p>\n\n\n\n
gs7.zip GS\u539f\u4ee3\u7801<\/p>\n\n\n\n
tinkersource.zip \u6676\u4f53\u7ed3\u6784\u5efa\u6a21tinker \u539f\u4ee3\u7801\u53ca\u8bf4\u660e<\/p>\n\n\n\n
Fortran \u539f\u4ee3\u7801<\/p>\n\n\n\n
ccp4-4.1.1.zip ccp4\u6676\u4f53\u5b66\u539f\u4ee3\u7801\u5e93<\/p>\n\n\n\n
Db9807d.for \u8457\u540d\u7684Rietveld\u7cbe\u4fee\u7a0b\u5e8f(98\u7248\uff09<\/p>\n\n\n\n
dbws94.zip \u8457\u540d\u7684Rietveld\u7cbe\u4fee\u7a0b\u5e8f(94\u7248\uff09<\/p>\n\n\n\n
dbw89.zip \u8457\u540d\u7684Rietveld\u7cbe\u4fee\u7a0b\u5e8f(89\u7248\uff09<\/p>\n\n\n\n
camel1975.txt \u5438\u6536\u6821\u6b6375<\/p>\n\n\n\n
camel1977.txt \u5438\u6536\u6821\u6b6377<\/p>\n\n\n\n
atom.zip \u8ba1\u7b97\u539f\u5b50\u7535\u8377\u5bc6\u5ea6<\/p>\n\n\n\n
reci.zip \u7535\u5b50\u884d\u5c04\u6307\u6807\u5316<\/p>\n\n\n\n
fousyn.zip \u6700\u5927\u71b5\u5206\u6790\u539f\u4ee3\u7801<\/p>\n\n\n\n
treor.zip \u672a\u77e5\u6676\u80de\u53c2\u6570\u7684\u6307\u6807\u5316\u539f\u4ee3\u7801<\/p>\n\n\n\n
prium.zip \u6307\u6807\u5316\u548c\u6676\u80de\u53c2\u6570\u7cbe\u4fee<\/p>\n\n\n\n
cif_rho.dic \u521b\u5efaCIF \u6570\u636e\u76ee\u5f55<\/p>\n\n\n\n
ciftbx.zip CIF \u6587\u4ef6\u8f6c\u6362<\/p>\n\n\n\n
FATRIET.zip Rietveld\u7cbe\u4fee\u8f6f\u4ef6\u539f\u4ee3\u7801<\/p>\n\n\n\n
al3_f \u77e9\u9635\u8fd0\u7b97<\/p>\n\n\n\n
derb.zip \u7c89\u6676\u5b9a\u91cf\u5206\u6790\uff08PDF\u6cd5)<\/p>\n\n\n\n
diffuse.zip PDF\u6cd5\u5168\u8c31\u62df\u5408\u7ed3\u6784\u7cbe\u4fee<\/p>\n\n\n\n
espoir00.zip ESPOIR3.5 WINDOWS\u7248<\/p>\n\n\n\n
fullprof97.zip rietveld \u5168\u8c31\u62df\u5408<\/p>\n\n\n\n
getspec.zip \u8ba1\u7b97\u5bf9\u79f0\u64cd\u4f5c<\/p>\n\n\n\n
mprof96.zip Rietveld \u7684\u62df\u5408\u7a0b\u5e8f<\/p>\n\n\n\n
ortep00.zip ORTEP-III \u70ed\u692d\u7403\u7ed8\u56fe\u7a0b\u5e8f<\/p>\n\n\n\n
overlap.zip \u7528Le Bail\u6cd5\u4ea7\u751f\u7ed3\u6784\u56e0\u5b50<\/p>\n\n\n\n
powder91.zip \u7c89\u672b\u56fe\u6307\u6807\u5316\u7a0b\u5e8f<\/p>\n\n\n\n
sir92.zip \u7ed3\u6784\u89e3\u6790\u7a0b\u5e8f<\/p>\n\n\n\n
sirpow92.zip \u7c89\u672b\u6cd5\u7ed3\u6784\u89e3\u6790<\/p>\n\n\n\n
xdgeom.zip<\/p>\n\n\n\n
xdini.zip \u5c0f\u5206\u5b50\u6676\u4f53\u7ed3\u6784\u5206\u6790\u8f6f\u4ef6<\/p>\n\n\n\n
xtal00.zip \u5c0f\u5206\u5b50\u6676\u4f53\u7ed3\u6784\u5206\u6790\u8f6f\u4ef6<\/p>\n\n\n\n
gn21.zip \u795e\u7ecf\u7f51\u7edc\u6f14\u793aPASCAL<\/p>\n\n\n\n
gtsplb.for \u8ba1\u7b97\u7279\u5b9a\u4f4d\u7f6e\u8868<\/p>\n\n\n\n
Tools \u5de5\u5177<\/p>\n\n\n\n
xc1.zip x\uff0dwindows\u7cfb\u7edf\u539f\u4ee3\u7801<\/p>\n\n\n\n
XWIN32.zip x\uff0dwindows\u7cfb\u7edf\u539f\u4ee3\u7801<\/p>\n\n\n\n
F2C FORTRAN \u5230C\u7684\u8f6c\u6362\uff0c\u4e0d\u719f\u6089fortran\u7a0b\u5e8f\u8005\u7684\u798f\u97f3kriber_1.1.zip pascal\u5230C\u7684\u8f6c\u6362\u7a0b\u5e8f<\/p>\n\n\n\n
\u6676\u4f53\u5b66\u7ecf\u5178Fortran\u539f\u4ee3\u7801<\/p>\n\n\n\n
fordap-70 exfft-80 treor-90 espoir-00<\/p>\n\n\n\n
reduce-70 multan-80 dicvol-91 ortep-00<\/p>\n\n\n\n
ortep-71 normal-80 powder-91 xtal-00<\/p>\n\n\n\n
sadiana-71 search-80 rmca-92 diffax-01<\/p>\n\n\n\n
wilson-72 dicvol-82 pluto-92<\/p>\n\n\n\n
xanadu-73 xrs-82 sir-92#<\/p>\n\n\n\n
agnost-74 mprof-83 sirpow-92#<\/p>\n\n\n\n
icon-74 ito-84 stidy-92<\/p>\n\n\n\n
linex-74 orffe-84 tmacle-92<\/p>\n\n\n\n
camel-75 struplo-84 xyz-92<\/p>\n\n\n\n
latcon-75 treor-84 absorb-93<\/p>\n\n\n\n
dls-76 block-85 parst-93<\/p>\n\n\n\n
shelx-76 exfft-85 sbgbbg-93<\/p>\n\n\n\n
camel-77 getspec-85 strumo-93<\/p>\n\n\n\n
lazy-77 geom-85 aritve-94<\/p>\n\n\n\n
louv-77 lsq-85 dbws-94<\/p>\n\n\n\n
xfls-77 ortep-85 cascade-95<\/p>\n\n\n\n
celref-78 rbls-85 difabs-95<\/p>\n\n\n\n
fordap-79 search-85 gtsym-95<\/p>\n\n\n\n
shelx-79 sort-85 ccsl-96<\/p>\n\n\n\n
volcal-79 wtanal-85 lhpm-96<\/p>\n\n\n\n
hole-86 mprof-96<\/p>\n\n\n\n
powd12-86 ortep-96<\/p>\n\n\n\n
shadow-86 struvir-96<\/p>\n\n\n\n
shelxs-86 caos-97<\/p>\n\n\n\n
visser-86 cif2sx-97<\/p>\n\n\n\n
appleman-87 difrac-97<\/p>\n\n\n\n
ito-87 dirdif-97<\/p>\n\n\n\n
patsee-87 fullprof-97<\/p>\n\n\n\n
pawley-87 glassvir-97<\/p>\n\n\n\n
wppf-87 laue-97<\/p>\n\n\n\n
dragon-88 tessel-97<\/p>\n\n\n\n
mcmag-88 xhydex-97<\/p>\n\n\n\n
pro-fit-88 iucrval-98<\/p>\n\n\n\n
xlat-88 lapod-98<\/p>\n\n\n\n
dbw-89 thma-98<\/p>\n\n\n\n
fullprof-89 espoir-99<\/p>\n\n\n\n
rietan-89 hydrogen-99<\/p>\n\n\n\n
pluto-?? promet-99<\/p>\n\n\n\n
————————————————————————————— DISK 4<\/p>\n\n\n\n
\u7c89\u672b\u6cd5\u8f6f\u4ef6<\/p>\n\n\n\n
winfp99.zip WINFITPROF99 \u7c89\u672b\u6cd5\u89e3\u7ed3\u6784\u8f6f\u4ef6<\/p>\n\n\n\n
winmprof.zip \u7c89\u672b\u6cd5\u7ed3\u6784\u7cbe\u4fee\u7a0b\u5e8f(2001\u7248\uff09<\/p>\n\n\n\n
ensetup.exe \u7c89\u672b\u6cd5\u7ed3\u6784\u5206\u6790\u7a0b\u5e8f<\/p>\n\n\n\n
zpowder.exe \u7c89\u672b\u884d\u5c04\u5206\u6790\u8f6f\u4ef6\uff08\u65b0\u7248\uff09<\/p>\n\n\n\n
simref.zip \u7c89\u672b\u6cd5\u7ed3\u6784\u7cbe\u4fee\u7a0b\u5e8f\uff08\u542b\u539f\u4ee3\u7801\uff09<\/p>\n\n\n\n
simpro.zip \u7c89\u672b\u884d\u5c04\u7ed3\u6784\u7cbe\u4fee\uff08\u542b\u539f\u4ee3\u7801\uff09<\/p>\n\n\n\n
xrs-dist.zip XRS82\u7c89\u672b\u884d\u5c04\u7ed3\u6784\u5206\u6790\uff0cDOS \u542b\u539f\u4ee3\u7801<\/p>\n\n\n\n
xrc32.zip \u7c89\u6676X\u5c04\u7ebf\u6570\u636e\u7ed8\u56fe\u3001\u6392\u5e8f\u5206\u6790\u7b49<\/p>\n\n\n\n
El_dens.zip \u7c89\u672b\u6570\u636e\u7535\u5b50\u5bc6\u5ea6\u8ba1\u7b97<\/p>\n\n\n\n
xfit32 \u5168\u8c31\u62df\u5408\u5085\u7acb\u53f6\u5206\u6790\uff08FOURYA+XFIT\uff09<\/p>\n\n\n\n
DBWS9807.zip \u7c89\u672b\u6cd5Rietveld\u7ed3\u6784\u5206\u6790\u7a0b\u5e8f\u6700\u65b0\u5168\u5957\u8f6f\u4ef6\uff08\u542b\u539f\u4ee3\u7801\uff0c\u8bf4\u660e\u548c\u793a\u4f8b\uff09<\/p>\n\n\n\n
arit.zip Rietveld \u7a0b\u5e8fARIT is a Rietveld method software including the original Le Bail method (1987), working with a curious profile shape description by Fourier series.<\/p>\n\n\n\n
aritve.zip \u73bb\u7483\u578b\u7ed3\u6784\u7684Rietveld\u5206\u6790\uff0cARITVE models glass structures by a Rietveld-type<\/p>\n\n\n\n
xraydraw.zip \u674e\u56fd\u6b66\u5f00\u53d1\u7684\u7c89\u6676X\u5c04\u7ebf\u884d\u5c04\u56fe\u5f62\u5904\u7406\u8f6f\u4ef6<\/p>\n\n\n\n
ED9214.zip \u5e26WINDOWS\u6570\u636e\u7f16\u8f91\u7a0b\u5e8f\u7684\u6676\u80de\u53c2\u6570\u7cbe\u4fee\u53ca\u6307\u6807\u5316\u7a0b\u5e8f<\/p>\n\n\n\n
X\u5c04\u7ebf\u7c89\u6676\u884d\u5c04\u7a0b\u5e8f\u5305.zip \u672c\u4eba\u5f00\u53d1\u7684\u5305\u542b\u7ed8\u56fexraydraw\u548c\u6676\u80de\u53c2\u6570\u7cbe\u4feeED9214\u7684\u7c89\u6676\u884d\u5c04\u8f6f\u4ef6\u5305searchmooth_scr.zip \u672c\u4eba\u5f00\u53d1\u7684\u91c7\u7528\u65b0\u7b97\u6cd5\u7684\u884d\u5c04\u6570\u636e\u5e73\u6ed1\u5bfb\u5cf0\u539f\u4ee3\u7801\uff08c\u51fd\u6570\uff09<\/p>\n\n\n\n
ED9214_SCR.zip \u672c\u4eba\u5f00\u53d1\u76849214\u7a0b\u5e8f\u7684WINDOWS\u6570\u636e\u7f16\u8f91\u7a0b\u5e8f\u539f\u4ee3\u7801<\/p>\n\n\n\n
rmcaw95.zip \u884d\u5c04\u62df\u5408\u7a0b\u5e8f\uff08\u542b\u539f\u4ee3\u7801\uff09<\/p>\n\n\n\n
PkChopr.zip excel\u5b8f\u4ee3\u7801\u7684\u62df\u5408<\/p>\n\n\n\n
Stepcon.zip excel\u5b8f\u4ee3\u7801\u62df\u5408\u7ed8\u56fe<\/p>\n\n\n\n
mudmastr.zip \u8ba1\u7b97\u6676\u7c92\u5ea6\u548c\u6676\u683c\u7578\u53d8\u7684excell\u5b8f\u4ee3\u7801<\/p>\n\n\n\n
xray96.zip A program for producing idealised powder diffraction line<\/p>\n\n\n\n
profiles from overlapped powder diffraction patterns.<\/p>\n\n\n\n
This program may be used as a preliminary to the program<\/p>\n\n\n\n
CRYSIZ, for computing crystallite size and strain from<\/p>\n\n\n\n
the broadening of powder diffraction lines.<\/p>\n\n\n\n
winplotr.zip \u7c89\u672b\u6cd5\u7ed8\u56fe\uff08\u65b0\u7248\uff09<\/p>\n\n\n\n
InstMsi.exe<\/p>\n\n\n\n
InstMsi_v1.1_ForWin9x.zip<\/p>\n\n\n\n
isopro3.zip Isopro is an isotopic distribution<\/p>\n\n\n\n
MagePak.011011.win.zip \u52a8\u529b\u5b66\u7ed8\u56feA “kinemage” (kinetic image) is an authored illustration presented as an interactive computer display.<\/p>\n\n\n\n
MCE_VR_v11_exe.zip 3D\u7ed8\u56fe\u7a0b\u5e8f<\/p>\n\n\n\n
MCE_beta7_distribution.zip<\/p>\n\n\n\n
probe.2.1_6.000114.win.exe.zip “probe” generates “contact dots” at points on the van der Waals<\/p>\n\n\n\n
surface of atoms which are in close proximity to other atoms<\/p>\n\n\n\n
reduce.2.13_2.991005.win.exe.zip \u52a0H\u7a0b\u5e8f<\/p>\n\n\n\n
IdentificationTable.pdf \u6cb8\u77f3\u884d\u5c04\u9274\u5b9a\u6570\u636e<\/p>\n\n\n\n
\u4e00\u7ec4\u6709\u673a\u5206\u5b50\u7ed3\u6784\u56fe\u5f62\u663e\u793a\u7a0b\u5e8f\uff08DEMO\uff09<\/p>\n\n\n\n
democisi.exe Chemistry 4D- Draw<\/p>\n\n\n\n
carined.exe CARINE Crystallography<\/p>\n\n\n\n
cof45net.exe ChemOffice<\/p>\n\n\n\n
cd45wn32.exe ChemDraw<\/p>\n\n\n\n
con50.exe E-Lab Notebook Full Version – 14 Days Trial<\/p>\n\n\n\n
mol2mol40demo.exe<\/p>\n\n\n\n
cft.exe Chemical Formula Tutor<\/p>\n\n\n\n
dmupack.exe \u7ed8\u56feDRAWmolULTRApack<\/p>\n\n\n\n
ecelpre.exe Electrochemical Cells Pro<\/p>\n\n\n\n
ezellen.exe Elektrochemische Zellen Pro – Deutsch<\/p>\n\n\n\n
hchem5.exe \u56fe\u7247\u6f14\u793a<\/p>\n\n\n\n
ultradem.exe \u7ed83D\u5206\u5b50\u7ed3\u6784\u56fe<\/p>\n\n\n\n
umy2k.exe UltraMol 2000\u7248<\/p>\n\n\n\n
PoleMic.zip \u77ff\u7269\u9274\u5b9a\u7a0b\u5e8f\uff08\u5229\u7528\u77ff\u7269\u7684\u7279\u5f81\u6570\u636e\u5e93\u9274\u5b9a\u77ff\u7269\uff09x-ray-b_5.zip X\u5c04\u7ebf\u53cd\u5c04\u4eff\u771f<\/p>\n\n\n\n
phasanxdemo \u7c89\u672b\u6cd5\u8f6f\u4ef6<\/p>\n\n\n\n
newwx20.ZIP a XAS data analysis program\uff08DEMO\uff09breadth.zip \u7ebf\u5bbd\u5206\u6790\u7a0b\u5e8f\uff08DOS\uff09<\/p>\n\n\n\n
eracel.exe \u6676\u80de\u53c2\u6570\u7cbe\u4fee\u7a0b\u5e8f\uff08DOS\uff09<\/p>\n\n\n\n
superlat.zip X\u5c04\u7ebf\u884d\u5c04\u66f2\u7ebf\u8ba1\u7b97\uff08\u5e94\u53d8\u8bc4\u4f30\uff09<\/p>\n\n\n\n
perlib18.zip \u5143\u7d20\u5468\u671f\u8868<\/p>\n\n\n\n
plvinst.exe \u4e00\u4e2a\u7c89\u6676\u5206\u6790\u8f6f\u4ef6\uff08DOS\uff09<\/p>\n\n\n\n
\u539f\u4ee3\u7801<\/p>\n\n\n\n
partsys_0.1.zip 3D\u7ed8\u56fecpp\u539f\u4ee3\u7801<\/p>\n\n\n\n
xdini FOR\u539f\u4ee3\u7801<\/p>\n\n\n\n
xdgeom FOR\u539f\u4ee3\u7801<\/p>\n\n\n\n
gdis-0.74.zip \u7ed8\u56fe\u539f\u4ee3\u7801<\/p>\n\n\n\n
atomos.tgz \u5efa\u7acb\u521d\u59cb\u7ed3\u6784\u7684C\u539f\u4ee3\u7801<\/p>\n\n\n\n
mmdist.zip \u5fae\u5206\u5b50\u7ed3\u6784\u5206\u6790\u539f\u4ee3\u7801<\/p>\n\n\n\n
ciflib-v3-prod.zip CIFLIB – Class Library and C API escher.src.zip \u7b49\u6548\u70b9\u7cfb\u6f14\u793a\uff08JAVA\u7a0b\u5e8f\uff09<\/p>\n\n\n\n
gromacs-3.0.5.zip \u539f\u4ee3\u7801<\/p>\n\n\n\n
xtal-3.7.0.orig.zip VRML\u751f\u6210\u539f\u4ee3\u7801<\/p>\n\n\n\n
crystal.zip \u6676\u4f53\u7ed3\u6784\u663e\u793a\u539f\u4ee3\u7801<\/p>\n\n\n\n
shadow-2.3.2.zip shaow \u539f\u4ee3\u7801<\/p>\n\n\n\n
Atom.zip \u8ba1\u7b97\u539f\u5b50\u7535\u8377\u5bc6\u5ea6<\/p>\n\n\n\n
Dhklm.zip \u8ba1\u7b97\u8c03\u5236\u7ed3\u6784\u7684D\u503c<\/p>\n\n\n\n
fousyn.zip \u5dee\u503c\u5085\u7acb\u53f6\u548c\u5e15\u7279\u68ee\u5408\u6210<\/p>\n\n\n\n
Lazy.zip \u8ba1\u7b97\u7406\u8bba\u884d\u5c04\u56fe<\/p>\n\n\n\n
Pirum.zip \u6307\u6807\u5316\u548c\u7cbe\u4fee\u6676\u80de\u53c2\u6570<\/p>\n\n\n\n
Profit.zip \u5355\u5cf0\u62df\u5408\u7a0b\u5e8f<\/p>\n\n\n\n
Reci.zip \u7535\u5b50\u884d\u5c04\u76f8\u5206\u6790<\/p>\n\n\n\n
Treor.zip \u672a\u77e5\u6676\u80de\u53c2\u6570\u7684\u6307\u6807\u5316<\/p>\n\n\n\n
Espoirsource.zip Espoir for Windows complete source code wulff.c Draw a Wulff Net<\/p>\n\n\n\n
pgplot.zip \u56fe\u5f62\u663e\u793a\uff08for\u539f\u4ee3\u7801\uff09<\/p>\n\n\n\n
C\u539f\u4ee3\u7801<\/p>\n\n\n\n
atoms.zip \u86cb\u767d\u7ed3\u6784\u663e\u793a\u539f\u4ee3\u7801c\u8bed\u8a00<\/p>\n\n\n\n
diff.zip \u62df\u5408c\u539f\u4ee3\u7801<\/p>\n\n\n\n
dsql.3.zip \u5206\u5e03\u5f0fSQL C\u539f\u4ee3\u7801<\/p>\n\n\n\n
dynal.zip \u7a97\u4f53\u5e93<\/p>\n\n\n\n
fda.zip fda\u8f93\u5165\u7a0b\u5e8f<\/p>\n\n\n\n
gcube2plt.c \u7acb\u65b9\u9ad8\u65af\u7b97\u6cd5<\/p>\n\n\n\n
gnuplot.zip \u66f2\u7ebf\u7ed8\u56fe<\/p>\n\n\n\n
gpcontrib.zip \u6570\u636e\u62df\u5408\u7ed8\u56fe\u51fd\u6570\u5e93<\/p>\n\n\n\n
graph.zip \u7ed8\u56fec\u539f\u4ee3\u7801<\/p>\n\n\n\n
mm2_params.c SIFT THROUGH MM2\/MM3 OUTPUT FILE FOR ERRORS REGARDING MISSING PA RAMETERS AND DERIVE THOSE PARAMETERS BASED ON SIMILARITIES<\/p>\n\n\n\n
BETWEEN THE INVOLVED ATOM TYPES AND EXISTING PARAMETERS FOR OTHER<\/p>\n\n\n\n
ATOM TYPES (OR BY ASKING USER IF NO SIMILAR CASES EXIST).<\/p>\n\n\n\n
mmconv.zip mol\/mol2 and MM2\/MM3 file conversions<\/p>\n\n\n\n
mmio.zip \u5b8f\u6a21\u578b\u7ed3\u6784\u8f93\u5165\u8f93\u51faMMIO stands for “MacroModel Input-Output”<\/p>\n\n\n\n
moldy.zip \u5206\u5b50\u52a8\u529b\u5b66\u4eff\u771f\u7a0b\u5e8f<\/p>\n\n\n\n
multi.zip \u5206\u5b50\u7ed8\u56fe<\/p>\n\n\n\n
nab5.zip \u521b\u5efa\u63cf\u8ff0\u9ad8\u5206\u5b50\u6838\u9178<\/p>\n\n\n\n
nab5_v10.zip<\/p>\n\n\n\n
nab5_v11.zip<\/p>\n\n\n\n
otf.zip \u9ad8\u5206\u5b50\u7ed8\u56fe\u7a0b\u5e8f<\/p>\n\n\n\n
otf-0.2.zip<\/p>\n\n\n\n
periodic.zip<\/p>\n\n\n\n
quatfit.c \u56db\u5143\u7d20\u6cd5\u6dfb\u52a0\u539f\u5b50<\/p>\n\n\n\n
Raster3D_2.4b.zip \u7ed83d\u5206\u5b50\u56fe<\/p>\n\n\n\n
rayshade.4.0.zip \u5c04\u7ebf\u8ddf\u8e2a\u7a0b\u5e8f<\/p>\n\n\n\n
react.zip \u5316\u5b66\u53cd\u5e94\u52a8\u529b\u6a21\u62df\u7a0b\u5e8f<\/p>\n\n\n\n
react2.zip<\/p>\n\n\n\n
reg_sub.zip \u7531\u5206\u5b50\u632f\u52a8\u4ea7\u751fxyzThis program produces XYZ animation files for molecular vibrations repre sented by normal modes taken from output files from Aces2,Gamess, and Gaussian.<\/p>\n\n\n\n
spectrum.c \u4ea7\u751f\u5149\u8c31\u9891\u7387\u548c\u632f\u5e45<\/p>\n\n\n\n
steric.zip \u5206\u5b50\u53c2\u6570\u8ba1\u7b97\u914d\u4f4d\u952e\u89d2\u7b49<\/p>\n\n\n\n
translit.zip \u6570\u636e\u8f6c\u6362The TRANSLIT program is a powerful tool for such tasks. It converts an input file in one representation to the output file in another representation using<\/p>\n\n\n\n
an appropriate<\/p>\n\n\n\n
vaxtostd.c<\/p>\n\n\n\n
viewmol-2.2.1.zip \u86cb\u767d\u5206\u5b50\u7ed8\u56fe<\/p>\n\n\n\n
viewtools.zip 3d\u56fe\u5f62\u7684\u89c2\u770b\u548c\u6253\u5370<\/p>\n\n\n\n
visad1_1.zip \u4ea4\u4e92\u5f0f\u8fd0\u7b97\u7cfb\u7edf<\/p>\n\n\n\n
atomos.zip PIMM molecular mechanics package worldwide as an efficient tool for the<\/p>\n\n\n\n
creation of starting structures.<\/p>\n\n\n\n
atvolV1.2.zip “atvol” calculates the volumes of atoms in a PDB file by splitting the atoms along the bon ds (at the seams) and performing Monte Carlo integration<\/p>\n\n\n\n
reduceV2.15.source.zip \u539f\u4ee3\u7801program for adding hydrogens to a Protein DataBank (PDB) molecular stru cture file. It was developed at Duke University in the lab of David and Jane Richardson<\/p>\n\n\n\n
probe.2.8.011009.source.zip reading<\/p>\n\n\n\n
atomic coordinates in protein databank (PDB) format files and writing<\/p>\n\n\n\n
color-coded dot lists (spikes where atoms clash) for inclusion in a<\/p>\n\n\n\n
kinemage<\/p>\n\n\n\n
platon.zip \u539f\u4ee3\u7801\uff08FOR\uff09<\/p>\n\n\n\n
vbrun60sp5.zip<\/p>\n\n\n\n
MCE_VR_v11_src.zip 3D\u7ed8\u56fe\u539f\u4ee3\u7801<\/p>\n\n\n\n
MCE_beta7_source.zip<\/p>\n\n\n\n
mage.6.02.020211.zip \u52a8\u529b\u5b66\u7ed8\u56feC\u539f\u4ee3\u7801<\/p>\n\n\n\n
GX_src.zip GS\u7ed3\u6784\u5206\u6790\u7a0b\u5e8f\u539f\u4ee3\u7801<\/p>\n\n\n\n
fragpro1.zip<\/p>\n\n\n\n
dang1.6src.zip \u539f\u4ee3\u7801Dang is a simple UNIX C++ program to read a Protein DataBank (PDB) molecular structure coordinate file and generates a table of several<\/p>\n\n\n\n
useful geometric measurements for each residue or base.<\/p>\n\n\n\n
cluster.1.1.011024.zip C++ program to build lists of collections<\/p>\n\n\n\n
of interacting items from records containing interacting pairs<\/p>\n\n\n\n
and larger fragments.<\/p>\n\n\n\n
It reads in lines consisting of two or more names and output<\/p>\n\n\n\n
connected clusters of names<\/p>\n\n\n\n
ciftbx.zip (For)This is a version of CIFtbx which has been extended to work with DDL 2 and mmCIF a s well as with DDL 1.4 and core CIF dictionaries.<\/p>\n\n\n\n
bndlstV1.6.source.zip \u6587\u4ef6\u8f6c\u6362”bndlst” lists connectivity information for atoms in a PDB<\/p>\n\n\n\n
file. It puts the information out in a tabular form<\/p>\n\n\n\n
kalkulator.zip \u8ba1\u7b97\u5668<\/p>\n\n\n\n
kalkulator-inst.exe \u5316\u5b66\u8ba1\u7b97\u56682.37<\/p>\n\n\n\n
thechemicalcalculator.exe \u5316\u5b66\u8ba1\u7b97<\/p>\n\n\n\n
chemxb.zip \u539f\u5b50\u3001\u5316\u5b66\u952e\u548c\u7ed3\u6784\u5b66\u4e60\u8f6f\u4ef6\uff08\u542b\u89e3\u5bc6\u7a0b\u5e8f\uff09<\/p>\n\n\n\n
———————————————————————————<\/p>\n\n\n\n
DISK 5<\/p>\n\n\n\n
\u5355\u6676\u8f6f\u4ef6<\/p>\n\n\n\n
zrasmov.exe \u7ed3\u6784\u5206\u6790<\/p>\n\n\n\n
dirdif99.zip \u6676\u4f53\u7ed3\u6784\u5206\u6790<\/p>\n\n\n\n
XTAL_GX.zip \u6676\u4f53\u7ed3\u6784\u5206\u6790<\/p>\n\n\n\n
gsaskit.exe \u5355\u6676\u7ed3\u6784\u7a0b\u5e8f\uff08\u65b0\u7248\uff09<\/p>\n\n\n\n
Xhydex.zip (dbos.zip) \u6c22\u539f\u5b50\u5b9a\u4f4dXHYDEX is a program written in a simple subset of Fortran (designed to be reasonably machine independent) which uses crystallographically determined molecular parameters t o infer the positions of hydride ligands in metal cluster complexes<\/p>\n\n\n\n
zwingx32.zip \u6676\u4f53\u7ed3\u6784\u89e3\u6790\u8f6f\u4ef6\u5305\uff08\u5185\u542b\u6ce8\u518c\u6587\u4ef6WinGX-license\uff092001.5.7\u7248<\/p>\n\n\n\n
crystals-b1170-jan02-setup.exe \u6676\u4f53\u7ed3\u6784\u89e3\u6790\u7a0b\u5e8f2002.1 \u7248<\/p>\n\n\n\n
zthma32.zip \u70ed\u9707\u52a8\u5206\u6790For thermal motion analysis, including internal torsion<\/p>\n\n\n\n
pgms_ntp6.zip GAMESS – \u534a\u7ecf\u9a8c\u8ba1\u7b97\u53ca\u4ece\u5934\u8ba1\u7b97\u514d\u8d39\u8f6f\u4ef6\u5305<\/p>\n\n\n\n
topkat.exe TOPKAT DEMO\u7a0b\u5e8f<\/p>\n\n\n\n
diva.exe \u751f\u7269\u5316\u5b66\u7ed3\u6784\u5206\u6790DEMO\u7a0b\u5e8f<\/p>\n\n\n\n
SWS.zip \u4e00\u7ec4DOS\u7a0b\u5e8f\uff08\u5305\u62ec\u5bf9\u79f0\u7fa4\u6295\u70b9\uff0c\u7b49\u6548\u70b9\u5bf9\u79f0\uff0c\u70b9\u7fa4\u6676\u9762\uff0c\u5143\u7d20\u5468\u671f\u8868\uff0c\u884d\u5c04\u4eff\u771f\uff0c2D\u7ed8\u56fe\uff0c\u8d64\u5e73\u6295\u5f71\uff0c\u5085\u7acb\u53f6\u53d8\u6362\u6f14\u793a\uff0c\u6676\u4f53\u4e60\u6027\u56fe\uff0c\u6676\u4f53\u7ed3\u6784\u56fe\uff0cRietveld \u4eff\u771f\u56fe\uff0c\u5e73\u9762\u7fa4\uff0c\u52b3\u57c3\u884d\u5c04\u4eff\u771f\u7b4916\u4e2a<\/p>\n\n\n\n
\u7a0b\u5e8f\uff0c\u542b\u8bf4\u660e\uff09<\/p>\n\n\n\n
jana2000.zip jana2000 ( Version : 09\/01\/2002)<\/p>\n\n\n\n
crystinfo.zip \u6676\u4f53\u8f6f\u4ef6<\/p>\n\n\n\n
nochaos.zip \u7528\u8ddd\u79bb\u7ea6\u675f\u6cd5\u4e00\u822c\u4f4d\u7f6e<\/p>\n\n\n\n
laue.zip T his program will read a SHELX formatted .HKL file and calculate the<\/p>\n\n\n\n
R(int) based on F (or on F^2 as in SHELXL93) for all Laue groups.<\/p>\n\n\n\n
Volcal.zip \u591a\u9762\u4f53\u4f53\u79ef\u548c\u626d\u66f2\u53c2\u6570\u8ba1\u7b97\u7a0b\u5e8f<\/p>\n\n\n\n
ster1_12.zip \u5206\u5b50\u952e\u8ba1\u7b97<\/p>\n\n\n\n
spg.zip Space Group Explorer(\u56fd\u9645\u8868\u7a7a\u95f4\u7fa4\uff09<\/p>\n\n\n\n
atomic11.zip \u5143\u7d20\u5468\u671f\u8868\uff08\u5404\u79cd\u6709\u5173\u5143\u7d20\u7684\u6570\u636e\uff0c\u7269\u7406\u6570\u636e\uff0cX\u5c04\u7ebf\u53c2\u6570\uff0c\u540c\u4f4d\u7d20\uff0c\u7535\u5b50\u5c42\u7ed3\u6784\u7b49\uff0c\u542b\u89e3\u7834\u7a0b\u5e8f\uff09<\/p>\n\n\n\n
labdemo2.exe \u8d28\u6784\u5206\u6790\u8f6f\u4ef6\uff08demo)<\/p>\n\n\n\n
formula_en.zip \u5206\u5b50\u91cf\u8ba1\u7b97<\/p>\n\n\n\n
\u865a\u62df\u73b0\u5b9e\uff08VRML\uff09\u53ca\u7ed8\u56fe\u5de5\u5177\u7c7b<\/p>\n\n\n\n
struvir.zip vrml\u5236\u4f5c\u8f6f\u4ef6<\/p>\n\n\n\n
Win_xtl.zip VRML\u7ed8\u56fe\uff08DEMO\u7ed8\u4e94\u4e2a\u72ec\u7acb\u539f\u5b50\uff09<\/p>\n\n\n\n
vmt.zip The VRML Molecule Toolbox<\/p>\n\n\n\n
MoDL2VRML.zip \u7f51\u7ad9\u4e0a\u7528\u7684\u5206\u5b50\u7ed3\u6784\u8f6c\u6362\u8f6f\u4ef6\uff08\u539f\u4ee3\u7801\uff09<\/p>\n\n\n\n
imwrm.zip \u4e00\u7ec4WRML\u7684\u5de5\u5177<\/p>\n\n\n\n
xtaldraw.zip 3D VRML \u751f\u6210\u7a0b\u5e8f<\/p>\n\n\n\n
im2wrl.tar.gz Convert an image to a VRML file \u539f\u4ee3\u7801<\/p>\n\n\n\n
pivoron10B3.exe vrml \u63d2\u4ef6<\/p>\n\n\n\n
wvSetup-21.exe \u53c8\u4e00\u4e2aVRML \u63d2\u4ef6<\/p>\n\n\n\n
glview.zip VRML \u6d4f\u89c8\u5668\u67e5\u4ef6<\/p>\n\n\n\n
quaref.zip QuaRef creates lists of reflections for dihedral (octagonal, decagonal, dodecagonal) and icosahed ral quasicrystals. It displays the 0th. layer as a static image and the the whole set of reflections in an in teractive 3D viewer<\/p>\n\n\n\n
draw24.zip \u56fe\u5f62\u89c2\u5bdf\u8f6f\u4ef6(\u770bmol\u6587\u4ef6\uff09<\/p>\n\n\n\n
setupov.zip \u539f\u5b50\u8f68\u9053\u7ed3\u6784<\/p>\n\n\n\n
sda130.exe \u7ed8\u56fe\u7a0b\u5e8f<\/p>\n\n\n\n
tess2src.zip \u539f\u4ee3\u7801Tessel2 is a 3D “compiler” to produce crystal and molecular models, parametric surfac es and several forms of sphere tesselations<\/p>\n\n\n\n
openxtal.exe Xtaldraw is an interactive computer graphics program that displays, manipulates and analyzes ball and stick, polyhedral and thermal ellipsoid colored drawings of any crystal structure or molecule. cn3d.win32.exe \u6709\u673a\u6570\u636e\u5e93\u56fe\u5f62\u663e\u793a\u7a0b\u5e8fCn3D is a helper application for your web browser that allows you to view 3-dimensional structures from NCBI’s Entrez retrieval service<\/p>\n\n\n\n
xtaldist.exe \u6676\u4f53\u7ed3\u6784\u7ed8\u56fe\uff08\u7f8e\u56fd\u77ff\u7269\u5b66\u5bb6\u6570\u636e\u5e93\u7ed8\u56fedraws crystal and molecular structures as ball and st ick\uff09<\/p>\n\n\n\n
TrueShadingdemo.zip TrueShading 1.0 is a new rendering tool for CaRIne Crystallography to create high quality graphics to be included in courses, posters, papers,…<\/p>\n\n\n\n
xpowinst.exe \u7ed8\u7406\u8bba\u884d\u5c04\u56feis a program that plots theoretical diffraction patterns of crystalline materials crxp.zip crystal painter v2.1 \u7ed8\u52363D\u6676\u4f53\u56fe<\/p>\n\n\n\n
Prax216.exe PRAX is molecular graphics program<\/p>\n\n\n\n
stereo30.zip StereoNet is a program for plotting on stereonets and performing 3D analysis and recalculatio ns.<\/p>\n\n\n\n
diamond21c.zip \u6676\u4f53\u7ed3\u6784\u7ed8\u56fe\uff08DIAMOND2.1c \u542b\u89e3\u5bc6\u7a0b\u5e8f\uff09<\/p>\n\n\n\n
patch21e.zip DIAMOND2.1c \u76842.1e\u5347\u7ea7\u7a0b\u5e8f<\/p>\n\n\n\n
mercury_1_0.exe 3d\u6676\u4f53\u7ed3\u6784\u7ed8\u56fe<\/p>\n\n\n\n
Atomwin.zip ATOMS 4.0\u6700\u597d\u7684\u6676\u4f53\u7ed3\u6784\u7ed8\u56fe\u8f6f\u4ef6(\u674e\u56fd\u6b66\u6c49\u5316\u7684ATOMS windows\u6b63\u5f0f\u7248\uff09<\/p>\n\n\n\n
Atdem51.exe ATOMS 5.1 \u6676\u4f53\u7ed3\u6784\u7ed8\u56fe\u8f6f\u4ef6\uff08DEMO\uff09<\/p>\n\n\n\n
ATOMS60.exe ATOMS 6.0\u7248\uff08\u6ce8\u518c\u7801QXAFK-BZNR\uff096.1\u7248OUZKB-LMXA<\/p>\n\n\n\n
SHAPE70.exe \u6676\u4f53\u7ed8\u56fe\uff08\u6ce8\u518c\u7801AQZ-BDNVV\uff0cAQZ-BDNWW\uff09<\/p>\n\n\n\n
Shdem60.exe \u6676\u4f53\u6676\u5f62\u7ed8\u56fe(demo)<\/p>\n\n\n\n
carined.exe CaRIne Crystallography\uff08DEMO\uff09\u6676\u4f53\u7ed3\u6784\u7ed8\u56fe<\/p>\n\n\n\n
IkaGus_02.exe \u7ed8\u56fe\u7a0b\u5e8f<\/p>\n\n\n\n
texture.exe \u7ed8\u6781\u56fe<\/p>\n\n\n\n
PCM2Dzip.zip \u7ed8\u5206\u5b50\u7ed3\u6784\u56fe\uff08demo\uff09<\/p>\n\n\n\n
MoldaBeans1_0a.exe \u5206\u5b50\u5efa\u6478\u548c\u7ed8\u56feMolecular modeling and molecular graphics<\/p>\n\n\n\n
morphy98_NT(demo).zip MORPHY is a program to perform a topological analysis as formulated by the t heory of “Atoms in Molecules” (AIM) developed by Bader and co-workers [1,2,3]. It can analyze a wave function of a molecule or complex in terms of charge transfer<\/p>\n\n\n\n
molda65e.exe molda72a2-02-11.zip MOLDA Molecular modeling and molecular graphics<\/p>\n\n\n\n
\u6587\u4ef6\u8f6c\u6362<\/p>\n\n\n\n
convert301.zip \u6587\u4ef6\u8f6c\u6362<\/p>\n\n\n\n
cif2pdb_shar.zip cif\u8f6c\u6362\u4e3apdb<\/p>\n\n\n\n
pdb2cif_shar.zip pdb\u8f6c\u6362\u4e3acif<\/p>\n\n\n\n
ConvX.exe \u6587\u4ef6\u683c\u5f0f\u8f6c\u6362<\/p>\n\n\n\n
csdshl.zip \u5251\u6865\u7ed3\u6784\u6570\u636e\u5e93FDAT \u8f6c\u6362\u4e3aSHELX \u683c\u5f0f\uff08\u539f\u4ee3\u7801\uff09<\/p>\n","protected":false},"excerpt":{"rendered":"
\u6211\u5e74\u8f7b\u65f6\u6536\u96c6\u7684\u5927\u7ea6\u4e00\u5343\u591a\u4e2a\u6709\u5173\u5355\u6676\u3001\u7c89\u6676\u3001\u6570\u636e\u5904\u7406\u3001\u7ed8\u56fe\u3001\u5316\u5b66\u7b49\u6676\u4f53\u5b66\u76f8\u5173\u8f6f\u4ef6\u53ca\u6e90\u4ee3\u7801\uff0c\u73b0\u6574\u7406\u51fa\u6765\u5927\u7ea6\u6709\u5341\u51e0\u4e2aG\u7684\u5bb9\u91cf<\/p>\n","protected":false},"author":2,"featured_media":0,"comment_status":"open","ping_status":"open","sticky":false,"template":"","format":"standard","meta":[],"categories":[74],"tags":[],"_links":{"self":[{"href":"http:\/\/www.crystalstar.org\/index.php?rest_route=\/wp\/v2\/posts\/6635"}],"collection":[{"href":"http:\/\/www.crystalstar.org\/index.php?rest_route=\/wp\/v2\/posts"}],"about":[{"href":"http:\/\/www.crystalstar.org\/index.php?rest_route=\/wp\/v2\/types\/post"}],"author":[{"embeddable":true,"href":"http:\/\/www.crystalstar.org\/index.php?rest_route=\/wp\/v2\/users\/2"}],"replies":[{"embeddable":true,"href":"http:\/\/www.crystalstar.org\/index.php?rest_route=%2Fwp%2Fv2%2Fcomments&post=6635"}],"version-history":[{"count":21,"href":"http:\/\/www.crystalstar.org\/index.php?rest_route=\/wp\/v2\/posts\/6635\/revisions"}],"predecessor-version":[{"id":6900,"href":"http:\/\/www.crystalstar.org\/index.php?rest_route=\/wp\/v2\/posts\/6635\/revisions\/6900"}],"wp:attachment":[{"href":"http:\/\/www.crystalstar.org\/index.php?rest_route=%2Fwp%2Fv2%2Fmedia&parent=6635"}],"wp:term":[{"taxonomy":"category","embeddable":true,"href":"http:\/\/www.crystalstar.org\/index.php?rest_route=%2Fwp%2Fv2%2Fcategories&post=6635"},{"taxonomy":"post_tag","embeddable":true,"href":"http:\/\/www.crystalstar.org\/index.php?rest_route=%2Fwp%2Fv2%2Ftags&post=6635"}],"curies":[{"name":"wp","href":"https:\/\/api.w.org\/{rel}","templated":true}]}}