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MolecularSynthesis

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NSF-sponsored project that attempts to create organic molecular compounds via AI Tree Search and Generative Graph Grammars

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Name		Name	Last commit message	Last commit date
.ipynb_checkpoints		.ipynb_checkpoints
.vscode		.vscode
Compatible Ditopic Topologies		Compatible Ditopic Topologies
GraphSynth.Base		GraphSynth.Base
GraphSynthConsole		GraphSynthConsole
MolecularSynthesis.GS.Plugin		MolecularSynthesis.GS.Plugin
OpenBabelStorage		OpenBabelStorage
OutPut Cifs		OutPut Cifs
TestingRules		TestingRules
data		data
examples		examples
examples_Kai		examples_Kai
input		input
output		output
packages		packages
produceCifForTabacco		produceCifForTabacco
rules		rules
test1/GA test		test1/GA test
zeo++-0.3		zeo++-0.3
.gitignore		.gitignore
.ipynb		.ipynb
0_fer_tobacco.cif		0_fer_tobacco.cif
10_fer_tobacco.cif		10_fer_tobacco.cif
11_fer_tobacco.cif		11_fer_tobacco.cif
12_fer_tobacco.cif		12_fer_tobacco.cif
13_fer_tobacco.cif		13_fer_tobacco.cif
14_fer_tobacco.cif		14_fer_tobacco.cif
15_fer_tobacco.cif		15_fer_tobacco.cif
16_fer_tobacco.cif		16_fer_tobacco.cif
17_fer_tobacco.cif		17_fer_tobacco.cif
18_fer_tobacco.cif		18_fer_tobacco.cif
19_fer_tobacco.cif		19_fer_tobacco.cif
1_fer_tobacco.cif		1_fer_tobacco.cif
20_fer_tobacco.cif		20_fer_tobacco.cif
21_fer_tobacco.cif		21_fer_tobacco.cif
22_fer_tobacco.cif		22_fer_tobacco.cif
23_fer_tobacco.cif		23_fer_tobacco.cif
24_fer_tobacco.cif		24_fer_tobacco.cif
25_fer_tobacco.cif		25_fer_tobacco.cif
26_fer_tobacco.cif		26_fer_tobacco.cif
27_fer_tobacco.cif		27_fer_tobacco.cif
28_fer_tobacco.cif		28_fer_tobacco.cif
29_fer_tobacco.cif		29_fer_tobacco.cif
2_fer_tobacco.cif		2_fer_tobacco.cif
30_fer_tobacco.cif		30_fer_tobacco.cif
31_fer_tobacco.cif		31_fer_tobacco.cif
32_fer_tobacco.cif		32_fer_tobacco.cif
33_fer_tobacco.cif		33_fer_tobacco.cif
34_fer_tobacco.cif		34_fer_tobacco.cif
35_fer_tobacco.cif		35_fer_tobacco.cif
36_fer_tobacco.cif		36_fer_tobacco.cif
37_fer_tobacco.cif		37_fer_tobacco.cif
38_fer_tobacco.cif		38_fer_tobacco.cif
39_fer_tobacco.cif		39_fer_tobacco.cif
3_fer_tobacco.cif		3_fer_tobacco.cif
40_fer_tobacco.cif		40_fer_tobacco.cif
41_fer_tobacco.cif		41_fer_tobacco.cif
42_fer_tobacco.cif		42_fer_tobacco.cif
43_fer_tobacco.cif		43_fer_tobacco.cif
44_fer_tobacco.cif		44_fer_tobacco.cif
45_fer_tobacco.cif		45_fer_tobacco.cif
46_fer_tobacco.cif		46_fer_tobacco.cif
47_fer_tobacco.cif		47_fer_tobacco.cif
48_fer_tobacco.cif		48_fer_tobacco.cif
49_fer_tobacco.cif		49_fer_tobacco.cif
4_fer_tobacco.cif		4_fer_tobacco.cif
50_fer_tobacco.cif		50_fer_tobacco.cif
51_fer_tobacco.cif		51_fer_tobacco.cif
52_fer_tobacco.cif		52_fer_tobacco.cif
53_fer_tobacco.cif		53_fer_tobacco.cif
54_fer_tobacco.cif		54_fer_tobacco.cif
55_fer_tobacco.cif		55_fer_tobacco.cif
56_fer_tobacco.cif		56_fer_tobacco.cif
57_fer_tobacco.cif		57_fer_tobacco.cif
58_fer_tobacco.cif		58_fer_tobacco.cif
59_fer_tobacco.cif		59_fer_tobacco.cif
5_fer_tobacco.cif		5_fer_tobacco.cif
60_fer_tobacco.cif		60_fer_tobacco.cif
61_fer_tobacco.cif		61_fer_tobacco.cif
62_fer_tobacco.cif		62_fer_tobacco.cif
63_fer_tobacco.cif		63_fer_tobacco.cif
64_fer_tobacco.cif		64_fer_tobacco.cif
65_fer_tobacco.cif		65_fer_tobacco.cif
66_fer_tobacco.cif		66_fer_tobacco.cif
67_fer_tobacco.cif		67_fer_tobacco.cif
68_fer_tobacco.cif		68_fer_tobacco.cif
69_fer_tobacco.cif		69_fer_tobacco.cif
6_fer_tobacco.cif		6_fer_tobacco.cif
70_fer_tobacco.cif		70_fer_tobacco.cif
71_fer_tobacco.cif		71_fer_tobacco.cif
72_fer_tobacco.cif		72_fer_tobacco.cif
73_fer_tobacco.cif		73_fer_tobacco.cif
74_fer_tobacco.cif		74_fer_tobacco.cif
75_fer_tobacco.cif		75_fer_tobacco.cif
76_fer_tobacco.cif		76_fer_tobacco.cif
77_fer_tobacco.cif		77_fer_tobacco.cif
78_fer_tobacco.cif		78_fer_tobacco.cif
79_fer_tobacco.cif		79_fer_tobacco.cif
7_fer_tobacco.cif		7_fer_tobacco.cif
80_fer_tobacco.cif		80_fer_tobacco.cif

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MORFSynthLearning

Molecule search and learning system

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NSF-sponsored project that attempts to create organic molecular compounds via AI Tree Search and Generative Graph Grammars

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