Conformer generation with OMEGA: learning from the data set and the analysis of failures
PCD Hawkins, A Nicholls - Journal of chemical information and …, 2012 - ACS Publications
We recently published a high quality validation set for testing conformer generators,
consisting of structures from both the PDB and the CSD (Hawkins, PCD et al. J. Chem. Inf …
consisting of structures from both the PDB and the CSD (Hawkins, PCD et al. J. Chem. Inf …
Conformer generation with OMEGA: learning from the data set and the analysis of failures.
PC Hawkins, A Nicholls - Journal of Chemical Information and …, 2012 - europepmc.org
We recently published a high quality validation set for testing conformer generators,
consisting of structures from both the PDB and the CSD (Hawkins, PCD et al. J. Chem. Inf …
consisting of structures from both the PDB and the CSD (Hawkins, PCD et al. J. Chem. Inf …
[PDF][PDF] Conformer Generation with OMEGA: Learning from the Data Set and the Analysis of Failures
PCD Hawkins, A Nicholls - 2012 - academia.edu
We recently published a high quality validation set for testing conformer generators,
consisting of structures from both the PDB and the CSD (Hawkins, PCD et al. J. Chem. Inf …
consisting of structures from both the PDB and the CSD (Hawkins, PCD et al. J. Chem. Inf …
Conformer generation with OMEGA: learning from the data set and the analysis of failures
PCD Hawkins, A Nicholls - Journal of chemical …, 2012 - pubmed.ncbi.nlm.nih.gov
We recently published a high quality validation set for testing conformer generators,
consisting of structures from both the PDB and the CSD (Hawkins, PCD et al. J. Chem. Inf …
consisting of structures from both the PDB and the CSD (Hawkins, PCD et al. J. Chem. Inf …
[引用][C] Conformer Generation with OMEGA: Learning from the Data Set and the Analysis of Failures
PCD Hawkins, A Nicholls - Journal of Chemical Information and …, 2012 - cir.nii.ac.jp
Conformer Generation with OMEGA: Learning from the Data Set and the Analysis of Failures |
CiNii Research CiNii 国立情報学研究所 学術情報ナビゲータ[サイニィ] 詳細へ移動 検索フォームへ …
CiNii Research CiNii 国立情報学研究所 学術情報ナビゲータ[サイニィ] 詳細へ移動 検索フォームへ …
[引用][C] Conformer Generation with OMEGA: Learning from the Data Set and the Analysis of Failures
PCD HAWKINS, A NICHOLLS - Journal of chemical …, 2012 - pascal-francis.inist.fr
Conformer Generation with OMEGA: Learning from the Data Set and the Analysis of Failures
CNRS Inist Pascal-Francis CNRS Pascal and Francis Bibliographic Databases Simple …
CNRS Inist Pascal-Francis CNRS Pascal and Francis Bibliographic Databases Simple …