Differenze

Queste sono le differenze tra la revisione selezionata e la versione attuale della pagina.

--- calcoloscientifico:userguide:boltz2 [17/12/2025 18:50] – fabio.spataro
+++ calcoloscientifico:userguide:boltz2 [17/12/2025 21:02] (versione attuale) – fabio.spataro
@@ Linea 14: / Linea 14: @@
 === Boltz2 python script ===
-Download the Boltz2 script file ''boltz2.py'' and save it:
+Download the ''Boltz2'' script file ''boltz2.py'' and save it:
 <code python boltz2.py>
@@ Linea 92: / Linea 92: @@
 Script ''slurm-boltz2-gpu-a100_40g.sh'' to run ''boltz2'' on 1 node with 1 A100 (40 GB) GPU (8 tasks per node):
-<code bash slurm-alphafold-gpu-a100_40g.sh>
+<code bash slurm-boltz2-gpu-a100_40g.sh>
 #!/bin/bash --login
 #SBATCH --job-name=boltz2
@@ Linea 115: / Linea 115: @@
 export NGC_API_KEY="INSERT API KEY HERE"
+export NIM_HTTP_API_PORT=$(hpc-find-free-tcp4-port 2>/dev/null || echo 8000)
 export TMPDIR=$HOME/nim-cache
 export APPTAINERENV_NGC_API_KEY=$NGC_API_KEY
@@ Linea 120: / Linea 121: @@
 export APPTAINERENV_NIM_CACHE=/nim-cache
 export APPTAINERENV_NIM_WORKSPACE=/nim-cache/workspace
+export APPTAINERENV_NIM_HTTP_API_PORT=$NIM_HTTP_API_PORT
 mkdir -p $HOME/nim-cache/workspace
-export NIM_HTTP_API_PORT=$(hpc-find-free-tcp4-port)
-export APPTAINERENV_NIM_HTTP_API_PORT=$NIM_HTTP_API_PORT
 apptainer instance run \
@@ Linea 135: / Linea 134: @@
 apptainer instance list
-# Attendo che il server boltz2 sia partito
+# Waiting for the boltz2 server to start
 until curl -sSf http://localhost:$NIM_HTTP_API_PORT/health/ready; do
-    echo "Server non pronto, attendo 10s..."
+    echo "Server not ready, waiting 10 seconds..."
     sleep 10
 done
-echo "Boltz2 server pronto!"
+echo "Boltz2 server ready!"
 # Testing boltz2