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ljmartin / autocorr_for_discourse.ipynb
Created April 27, 2020 05:22
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@ljmartin
ljmartin / autocorr_for_discourse.ipynb
Created April 27, 2020 05:28
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@ljmartin
ljmartin / run_ssw.py
Created May 26, 2020 00:40
import simtk
from simtk.openmm.app import *
from simtk.openmm import *
from simtk.unit import *
import mdtraj as md
from simtk import unit
from sys import stdout
import numpy as np
@ljmartin
ljmartin / button_pages.py
Created September 15, 2020 10:52
import SessionState
import streamlit as st
st.beta_set_page_config(
page_icon=":shark:",
layout="wide",
)
@ljmartin
ljmartin / calc_molport_pages.ipynb
Created October 17, 2020 06:55
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ljmartin / gist:fee03a98d19ef443f79d5d2a4d354b1e
Created October 26, 2020 04:52
This file has been truncated, but you can view the full file.
<svg baseProfile="full" height="3200px" version="1.1" viewBox="0 0 1600 3200" width="1600px" xml:space="preserve" xmlns="http://www.w3.org/2000/svg" xmlns:rdkit="http://www.rdkit.org/xml" xmlns:xlink="http://www.w3.org/1999/xlink">
<!-- END OF HEADER -->
<rect height="3200" style="opacity:1.0;fill:#FFFFFF;stroke:none" width="1600" x="0" y="0"> </rect>
<rect height="3200" style="opacity:1.0;fill:#FFFFFF;stroke:none" width="1600" x="0" y="0"> </rect>
<rect height="3200" style="opacity:1.0;fill:#FFFFFF;stroke:none" width="1600" x="0" y="0"> </rect>
<rect height="3200" style="opacity:1.0;fill:#FFFFFF;stroke:none" width="1600" x="0" y="0"> </rect>
<rect height="3200" style="opacity:1.0;fill:#FFFFFF;stroke:none" width="1600" x="0" y="0"> </rect>
<rect height="3200" style="opacity:1.0;fill:#FFFFFF;stroke:none" width="1600" x="0" y="0"> </rect>
<rect height="3200" style="opacity:1.0;fill:#FFFFFF;stroke:none" width="1600" x="0" y="0"> </rect>
<rect height="3200" style="opacity:1.0;fill:#FFFFFF;stroke:none" width="1600
@ljmartin
ljmartin / the_phytos.svg
Created October 26, 2020 04:52
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ljmartin / rcsb_date_now_example.ipynb
Created October 26, 2020 23:06
{
"cells": [
{
"cell_type": "code",
"execution_count": 1,
"metadata": {},
"outputs": [],
"source": [
"import json\n",
"import urllib\n",
@ljmartin
ljmartin / rcsb_past_week.ipynb
Created October 27, 2020 23:34
{
"cells": [
{
"cell_type": "code",
"execution_count": 1,
"metadata": {},
"outputs": [],
"source": [
"import json\n",
"import urllib\n",
@ljmartin
ljmartin / pandas_df_to_svg.ipynb
Created December 30, 2020 00:31
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