fixed errors 9

Author: ranimandepudi

.github/workflows/test-tinker.yml

@@ -273,7 +273,10 @@ jobs:
           
           # Define common flags
           LINK_FLAGS="-O3 -fopenmp"
-          LIBS="-L. -ltinker -lfftw3 -lgomp -lgfortran"
+          # Fix: Need -lfftw3 AND -lfftw3_threads/-lfftw3_omp for threaded FFT
+          # On some systems, the threading library is separate
+          # Order matters: tinker first, then fftw3, then threading libs, then base libs
+          LIBS="-L. -ltinker -lfftw3 -lfftw3_omp -lfftw3_threads -lgomp -lgfortran -lm"
           
           # 1. Analyze
           echo "Building analyze..."