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Application

Discovery Studio 0.8237442922374429 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.09302325581395349 Amorphous Cell 0.12248062015503876 CASTEP 0.5953488372093023 CDOCKER 0.2682170542635659 CHARMm 0.3581395348837209 COMPASS 0.3271317829457364 COMPASS III 0.0015503875968992248 COSMOtherm 0.024806201550387597 Catalyst 0.35038759689922483 Classical Simulations 1.0 Conformers 0.0031007751937984496 Crystallization 0.16434108527131783 DFTB Plus 0.007751937984496124 DMol3 0.33488372093023255 DPD 0.007751937984496124 Discover 0.03565891472868217 Forcite 0.3612403100775194 GULP 0.04961240310077519 LUDI 0.013953488372093023 LibDock 0.03875968992248062 LigandFit 0.08062015503875969 MCSS 0.0 MODELER 0.20930232558139536 MesoDyn 0.0 Mesocite 0.007751937984496124 Mesoscale 0.012403100775193798 Morphology 0.018604651162790697 Polymorph 0.004651162790697674 QMERA 0.0015503875968992248 Quantum Mechanics 0.9224806201550387 Reflex 0.13488372093023257 Reflex Plus 0.015503875968992248 Semi-empirical 0.018604651162790697 Sorption 0.04186046511627907 TURBOMOLE 0.0 VAMP 0.006201550387596899 Visualization 0.6961240310077519 X-Cell 0.0031007751937984496 ZDOCK 0.007751937984496124

Year

2003 0.0 2004 0.052083333333333336 2005 0.05555555555555555 2006 0.1076388888888889 2007 0.11805555555555555 2008 0.1875 2009 0.10416666666666667 2010 0.14930555555555555 2011 0.059027777777777776 2012 0.059027777777777776 2013 0.23958333333333334 2014 0.5590277777777778 2015 0.6979166666666666 2016 0.1423611111111111 2017 0.14583333333333334 2018 0.3784722222222222 2019 0.22569444444444445 2020 0.9097222222222222 2021 0.6701388888888888 2022 1.0 2023 0.3159722222222222 2024 0.5381944444444444 2025 0.19444444444444445 2026 0.11805555555555555

Keywords

synthesized 1.0 target 0.964872521246459 synthesis 0.30424929178470256 novel 0.22606232294617565 docking 0.15354107648725213 compound 0.1320113314447592 potential 0.1263456090651558 between 0.09518413597733712 visualization 0.09518413597733712 activity 0.08555240793201133 designed 0.07875354107648726 design 0.07025495750708215 analysis 0.055524079320113315 potent 0.0453257790368272 experimental 0.041359773371104816 medicinal 0.03342776203966006 binding 0.03286118980169972 promising 0.01586402266288952 chemical 0.013597733711048159 well 0.0113314447592068 energy 0.009631728045325779 vitro 0.009631728045325779 catalyst 0.00793201133144476 higher 0.0022662889518413596 inhibition 0.0
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