Listing the modules out of the top200 most loaded (according to Grafana), as of Nov 3, 2023, to keep track of what needs installing: - [x] 36. namd-multicore (GPU version using CUDA 11.8) - [x] 72. mujoco - [x] 74. gurobi - [x] 75. qgis - [x] 77. amber - [x] 78. openfoam - [x] 89. nvhpc - [x] 100. cdo - [x] 103. eccodes - [x] 107. quantumespresso - [x] 108. nextgenmap - [x] 110. orca Ali - may wait to see if there is an upcoming release - [x] 113. gamess-us - [x] 114. ambertools - [x] 116. ruby (3.2.2 installed, 2.x doesn't work due to requirement on outdated OpenSSL) - [x] 117. qca - [x] 118. qtkeychain - [x] 119. qscintilla - [x] 121. libspatialindex - [x] 126. hh-suite (see software ticket) - [x] 127. lmdb - [x] 128. openmm-alphafold (not needed, should be only OpenMM, Charles WIP) - [x] 129. geant4 (Ali) - [x] 134. vtk (Ali - Installed GCC version - serial) - [x] 135. bwa (see software ticket) - [x] 139. valgrind-mpi - [x] 141. hmmer - [x] 142. minc-toolkit - [x] 143. vmd - [x] 144. actc - [x] 146. optix - [x] 147. openbabel (Oliver w/ help from Bart) - [X] 149. kalign (see software ticket) - [x] 150. elpa (Ali) - [x] 153. plumed - [x] 154. ipython-kernel - [ ] 155. lammps-omp - [x] 159. kim-api - [x] 161. maven - [x] 162. coordgenlibs (Oliver) - [x] 163. maeparser (Oliver) - [x] 164. rdkit - [x] 165. rsem (see software ticket) - [x] 166. ncview - [ ] 168. gromacs-plumed (Oliver wip) - [x] 170. r-bundle-bioconductor - [x] 172. symengine - [x] 173. esmf (see software ticket) - [x] 175. mariadb-connector-c - [x] 176. starccm - [x] 178. g2clib (Oliver WIP) - [x] 179. g2lib (Oliver WIP) - [x] 182. itk (see software ticket) - [x] 183. sra-toolkit - [x] 184. libaec - [x] 185. ncl (Oliver WIP) - [x] 186. wannier90 - [x] 187. fsl - [x] 189. ants - [x] 190. samblaster - [x] 195. nlopt (see software ticket) - [x] 196. vasp - [x] 197. jags - [x] 198. git-annex - [x] 199. rosetta
Listing the modules out of the top200 most loaded (according to Grafana), as of Nov 3, 2023, to keep track of what needs installing: