def fasta func and rename of space
Browse files
README.md
CHANGED
|
@@ -1,5 +1,5 @@
|
|
| 1 |
---
|
| 2 |
-
title: MCP
|
| 3 |
emoji: 🧬
|
| 4 |
colorFrom: gray
|
| 5 |
colorTo: green
|
|
|
|
| 1 |
---
|
| 2 |
+
title: MCP Modal Protein Folding
|
| 3 |
emoji: 🧬
|
| 4 |
colorFrom: gray
|
| 5 |
colorTo: green
|
app.py
CHANGED
|
@@ -11,6 +11,38 @@ from modal_app import app, chai1_inference, download_inference_dependencies, her
|
|
| 11 |
|
| 12 |
# Definition of the tools for the MCP server
|
| 13 |
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
| 14 |
# Function to create a custom JSON config file
|
| 15 |
def create_custom_config(
|
| 16 |
num_trunk_recycles: int = 3,
|
|
|
|
| 11 |
|
| 12 |
# Definition of the tools for the MCP server
|
| 13 |
|
| 14 |
+
# Function to return a fasta file
|
| 15 |
+
def return_fasta_file() -> str:
|
| 16 |
+
"""Create a FASTA file from a protein sequence string.
|
| 17 |
+
|
| 18 |
+
Args:
|
| 19 |
+
sequence (str): The protein sequence string
|
| 20 |
+
name (str, optional): The name/identifier for the sequence. Defaults to "PROTEIN"
|
| 21 |
+
output_file (str, optional): Path to save the FASTA file. If None, saves to default location.
|
| 22 |
+
|
| 23 |
+
Returns:
|
| 24 |
+
str: Path to the created FASTA file
|
| 25 |
+
"""
|
| 26 |
+
# Clean the sequence by removing whitespace and newlines
|
| 27 |
+
sequence = ''.join(sequence.split())
|
| 28 |
+
|
| 29 |
+
# Set default name if none provided
|
| 30 |
+
if name is None:
|
| 31 |
+
name = "PROTEIN"
|
| 32 |
+
|
| 33 |
+
# Create FASTA content
|
| 34 |
+
fasta_content = f">{name}\n{sequence}\n"
|
| 35 |
+
|
| 36 |
+
# Set default output path if none provided
|
| 37 |
+
if output_file is None:
|
| 38 |
+
output_file = here / "inputs" / "chai1_custom_input.fasta"
|
| 39 |
+
|
| 40 |
+
# Write the FASTA file
|
| 41 |
+
with open(output_file, "w") as f:
|
| 42 |
+
f.write(fasta_content)
|
| 43 |
+
|
| 44 |
+
return str(output_file)
|
| 45 |
+
|
| 46 |
# Function to create a custom JSON config file
|
| 47 |
def create_custom_config(
|
| 48 |
num_trunk_recycles: int = 3,
|