mostafa-razavi TranSFF issues

mostafa-razavi / TranSFF

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Neural Network

#24 mostafa-razavi opened 4 years ago
8
MieSWF1012 results: branched alkanes

#23 mostafa-razavi opened 4 years ago
1
MieSWF1012 results: normal alkanes

#22 mostafa-razavi opened 4 years ago
2
TraPPE-SWF results

#21 mostafa-razavi opened 4 years ago
2
Comparing Nested PSO with pure PSO

#20 mostafa-razavi opened 4 years ago
2
TraPPE vs MiPPE vs TranSFF0

#19 mostafa-razavi closed 4 years ago
0
MBAR N_eff is very sensitive towards C sites type

#18 mostafa-razavi closed 4 years ago
0
Simulations

#17 mostafa-razavi closed 4 years ago
1
Mie-SWF development results

#16 mostafa-razavi opened 4 years ago
4
Mie-swf Rcut and Rswitch choise

#15 mostafa-razavi closed 4 years ago
1
CH3c and C parameters of TranSFF0 are wrong. NP bond lengths were mistakenly typed 1.4 instead of 1.54

#14 mostafa-razavi closed 4 years ago
2
Fine-tuning and testing TranSFF

#13 mostafa-razavi closed 4 years ago
2
AIChE Presentation

#12 mostafa-razavi closed 4 years ago
0
NIST Coumpounds

#11 mostafa-razavi opened 4 years ago
0
GOMC recalculate only energy NOT pressure

#10 mostafa-razavi opened 4 years ago
0
MBAR prediction accuracy for LJSF-C12

#9 mostafa-razavi opened 4 years ago
6
TransFF results

#8 mostafa-razavi opened 4 years ago
8
Explaining the details of using Auxiliary Nested PSO Optimization method to develop force fields using ITIC and MBAR

#7 mostafa-razavi opened 4 years ago
10
serial_pso vs parallel_pso vs. serial_pygmo

#6 mostafa-razavi opened 4 years ago
0
GPU on k80 doesn't accelerate GOMC much

#5 mostafa-razavi opened 4 years ago
0
Predict LJSF-C2-s3.730e119 using 9 reference simulations (Ns=1000)

#4 mostafa-razavi opened 4 years ago
1
GOMC structure has changed since I last modified it for FSHIFT

#3 mostafa-razavi opened 5 years ago
3
Predict TraPPE-C2 using two reference simulations (s3.74 and 3.76)

#2 mostafa-razavi opened 5 years ago
0
The psfgen.tcl won't work on chem20

#1 mostafa-razavi opened 5 years ago
2