From eaa1c6dd2b504ccac06312adcb6450cb1b962743 Mon Sep 17 00:00:00 2001 From: lingyuzeng Date: Wed, 6 Mar 2024 18:05:41 +0800 Subject: [PATCH] update --- README.md | 13 +++++++++++-- 1 file changed, 11 insertions(+), 2 deletions(-) diff --git a/README.md b/README.md index 38ff4a6..1ee5f54 100755 --- a/README.md +++ b/README.md @@ -11,6 +11,9 @@ conda create -n pyfastx modeller biopython pymol-open-source biopandas requests # 绘图环境 统计test.py conda install -c conda-forge seaborn -y pip install python-calamine + +# 一条命令: +micromamba create -n pyfastx modeller biopython pymol-open-source biopandas requests ipython ipykernel pydantic pyfastx ipython pyfastx modeller biopython pymol-open-source biopandas requests ipython ipykernel pydantic pyfastx ipython seaborn python-calamine -y -c conda-forge -c salilab -c bioconda ``` modeller注册码:`MODELIRANJE` @@ -152,7 +155,7 @@ ___ ------- 下面是多聚体修复记录: -1mwa: D 链 116 117 动画缺失,实际不缺失 +1mwa: B D 链 116 117 动画缺失,实际不缺失 3mbe: F链loop区域太多, 多聚体另外一部分结构缺失 @@ -177,4 +180,10 @@ cmd.select('sele', '4mji and (chain D or chain E or chain C or chain A or chain cmd.save('C:/Users/lingyuzeng/Documents/newfix0123/multimer_polymeric_extra/3ffc.pdb', 'sele') -# 先提取单体之后尝试修复 \ No newline at end of file +# 多聚体58个 + +先提取单体之后尝试修复 + +根据TCR-pMHC4.xlsx的记录信息提取单体,然后复制到pdb_test7, 手动修改 5ks9、5ksb的 I链peptide的缺失问题。 + +然后修复。 \ No newline at end of file