Added MDAnalysis in 2023

Golden_Repo/m/MDAnalysis/MDAnalysis-2.2.0-gcccoremkl-11.3.0-2022.1.0.eb

+easyblock = 'PythonBundle'
+
+name = 'MDAnalysis'
+version = '2.2.0'
+
+homepage = 'https://www.mdanalysis.org/'
+description = """MDAnalysis is an object-oriented Python library to analyze trajectories from molecular dynamics (MD)
+simulations in many popular formats."""
+
+toolchain = {'name': 'gcccoremkl', 'version': '11.3.0-2022.1.0'}
+
+dependencies = [
+    ('Python', '3.10.4'),
+    ('SciPy-bundle', '2022.05'),
+    ('matplotlib', '3.5.2'),
+    ('Biopython', '1.79'),
+    ('networkx', '2.8.4'),
+    ('tqdm', '4.64.0'),
+]
+
+use_pip = True
+download_dep_fail = True
+sanity_pip_check = True
+
+exts_list = [
+    ('mrcfile', '1.4.2', {
+        'checksums': ['447022f27b7ce4bf57f97010f092a811ce88635479de7f8a86449a0c9cb319fe'],
+    }),
+    ('GridDataFormats', '1.0.1', {
+        'modulename': 'gridData',
+        'checksums': ['ad2c9ab7d672a6d8c426de7d083eee4f3e2b0bd59391675d30683c768ab83cc4'],
+    }),
+    ('gsd', '2.5.3', {
+        'checksums': ['1593be39eb7a527647a40935a316d594ae20d4c11ff1383c25c8196376314d97'],
+    }),
+    ('msgpack', '1.0.4', {
+        'checksums': ['f5d869c18f030202eb412f08b28d2afeea553d6613aee89e200d7aca7ef01f5f'],
+    }),
+    ('mmtf-python', '1.1.3', {
+        'modulename': 'mmtf',
+        'checksums': ['12a02fe1b7131f0a2b8ce45b46f1e0cdd28b9818fe4499554c26884987ea0c32'],
+    }),
+    ('funcsigs', '1.0.2', {
+        'checksums': ['a7bb0f2cf3a3fd1ab2732cb49eba4252c2af4240442415b4abce3b87022a8f50'],
+    }),
+    ('fasteners', '0.17.3', {
+        'checksums': ['a9a42a208573d4074c77d041447336cf4e3c1389a256fd3e113ef59cf29b7980'],
+    }),
+    (name, version, {
+        'modulename': 'MDAnalysis',
+        'checksums': ['bf9c9b7a03404e65aad66215d4c2ff8834ab747551eeaee059ff3e599a99d322'],
+    }),
+]
+
+moduleclass = 'bio'