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ReactionMechanismGenerator
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RMG-website
A Django-powered website for Reaction Mechanism Generator (RMG)
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Rate coefficient units of some reactions need to be revisited
#284
agi-jaguar
opened
9 hours ago
0
add developer setup instructions to readme, make readme use MD format
#283
JacksonBurns
closed
2 weeks ago
1
RMG Server Error for Convert Chemkin File
#282
SONO641
closed
1 month ago
3
Remove RMG-Java code and fix various related glitches
#281
jonwzheng
closed
1 month ago
0
Add CI + test suite to RMG-website
#280
jonwzheng
opened
1 month ago
0
Update tracker from Google UA to Google GA4 for main branch
#279
jonwzheng
closed
2 months ago
1
Update RMG website with 2023 May workshop materials
#278
jonwzheng
closed
4 months ago
0
Confusing results in thermo data search.
#277
xiaoruiDong
opened
5 months ago
0
Fix various issues: Tdep solvation and nan handling for LaTeX rendering
#276
jonwzheng
closed
5 months ago
1
Temperature-dependent solvation prediction currently not working
#275
jonwzheng
closed
5 months ago
1
IndexError: list index out of range
#274
DiegoGuajardoP
closed
1 month ago
3
"AttributeError: 'NoneType' object has no attribute 'is_identical_to'"
#273
DiegoGuajardoP
closed
1 month ago
0
Update to Django 4.2
#272
jonwzheng
opened
6 months ago
0
AFM
#271
WernerHerzog
closed
5 months ago
1
Fix kinetic search due to removal of group additivity methods for rates from RMG-Py
#270
jonwzheng
closed
6 months ago
0
Update tracker from Google UA to GA4
#269
xiaoruiDong
closed
2 months ago
2
OSError: [Errno 28]
#268
Filozofafa
closed
8 months ago
4
OSError: [Errno 28]
#267
Filozofafa
closed
8 months ago
1
Unable to access some kinetic data
#264
jonwzheng
opened
10 months ago
1
Evaluate NASA Polynomial Tool on RMG Website fails
#263
Sayandeep00
closed
4 months ago
1
certain solvent library entries give "OverflowError"
#262
jonwzheng
closed
2 months ago
2
Homepage points to Latest Stable Version: 3.1.0. Needs updating.
#261
rwest
closed
6 months ago
0
ValueError: cannot convert float NaN to integer
#260
alongd
closed
5 months ago
2
create RMG-Java Kinetics Library
#259
wenjunzhong
closed
1 month ago
3
Limitations of CIR to resolve certain CAS numbers
#258
jonwzheng
opened
1 year ago
0
RMG is taking its database from a different location
#256
purkun01
closed
5 months ago
3
formation of unrelated radicle species which is not present in radicle.py.
#255
purkun01
closed
1 year ago
1
cannot debug as python print statement is not working
#254
purkun01
closed
1 year ago
1
Update RMG website environmental file
#253
xiaoruiDong
closed
6 months ago
4
Arkane input file format for pressure dependent networks not found when clicking "click here"
#251
sthakris
opened
1 year ago
0
Update environment.yml to latest version of solprop
#250
jonwzheng
closed
1 year ago
0
Update references and add info on "how to cite"
#249
yunsiechung
closed
1 year ago
1
Added 2022 RMG database paper to resources tab
#248
jonwzheng
closed
1 year ago
1
CAS Molecular Search Not Working
#247
calvinp0
closed
10 months ago
2
Display the origin of the data on the web interface
#246
chatelak
opened
1 year ago
0
RMG not handling pressure dependent - multiple Arrhenius type reactions correctly
#245
lynnrinkui
opened
1 year ago
1
Downgrade solprop from >=1.2 to =1.1
#242
jonwzheng
closed
2 years ago
0
KineticsError: Unable to calculate degeneracy when opening page https://rmg.mit.edu/database/kinetics/families/
#241
xiaoruiDong
closed
2 years ago
2
"ValueError: No valid NASA polynomial at temperature..." when loading certain kinetic families
#240
jonwzheng
closed
6 months ago
0
hi i get name error : name 'rms' is not defined in RMG-Py/examples/rmg/superminimal
#239
alirmg
closed
2 years ago
1
Add solid solubility prediction tool
#238
yunsiechung
closed
2 years ago
1
Add hyperlink link to the groups for the solvation group contribution method
#235
yunsiechung
closed
2 years ago
3
Update resources with link for RMG v3.0 publication.
#234
jonwzheng
closed
2 years ago
0
Fix to conda environment incompatibility error by adding pytorch dependency for chemprop_solvation
#233
jonwzheng
closed
2 years ago
0
Add libravatar to user profile avatars
#232
mefuller
opened
2 years ago
0
Clean migration files
#231
xiaoruiDong
closed
2 years ago
0
Update `chemprop_solvation` with a newer version >=0.0.3 to fix a bug with SoluteML
#230
yunsiechung
closed
2 years ago
0
RMG kinetics search cannot perform kinetics search
#229
alongd
closed
2 years ago
5
DNA Origami
#228
ghost
closed
3 years ago
0
Fix typo in processing Wilhoit thermo that leads to AttributeError
#227
jonwzheng
closed
2 years ago
0
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