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Application

Discovery Studio 1.0 Materials Studio 0.917713567839196 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0625 Amorphous Cell 0.10912698412698413 Blends 0.003968253968253968 CASTEP 0.6001984126984127 CDOCKER 0.2619047619047619 CHARMm 0.44246031746031744 COMPASS 0.21825396825396826 COMPASS III 0.013888888888888888 COSMObase 9.92063492063492E-4 COSMOconf 0.0 COSMOquick 0.001984126984126984 COSMOtherm 0.0873015873015873 Catalyst 0.36507936507936506 Classical Simulations 1.0 Conformers 9.92063492063492E-4 Crystallization 0.0625 DFTB Plus 0.001984126984126984 DMol3 0.34424603174603174 DPD 0.003968253968253968 Discover 0.018849206349206348 Forcite 0.26091269841269843 GULP 0.125 LUDI 0.03968253968253968 LibDock 0.07341269841269842 LigandFit 0.1130952380952381 MCSS 0.00496031746031746 MODELER 0.42162698412698413 MesoDyn 0.002976190476190476 Mesocite 0.003968253968253968 Mesoscale 0.011904761904761904 Morphology 0.00992063492063492 ONETEP 0.003968253968253968 Polymorph 0.002976190476190476 QSAR 0.0 Quantum Mechanics 0.933531746031746 Reflex 0.04662698412698413 Reflex Plus 0.001984126984126984 Semi-empirical 0.006944444444444444 Sorption 0.022817460317460316 TURBOMOLE 9.92063492063492E-4 VAMP 0.003968253968253968 Visualization 0.6775793650793651 X-Cell 0.001984126984126984 ZDOCK 0.022817460317460316

Year

2003 0.0 2004 0.05221932114882506 2005 0.06266318537859007 2006 0.17232375979112272 2007 0.11488250652741515 2008 0.17493472584856398 2009 0.16449086161879894 2010 0.15404699738903394 2011 0.09921671018276762 2012 0.020887728459530026 2013 0.4281984334203655 2014 0.7728459530026109 2015 0.5535248041775457 2016 0.08093994778067885 2017 0.13838120104438642 2018 0.3289817232375979 2019 0.17754569190600522 2020 0.8433420365535248 2021 0.6736292428198434 2022 1.0 2023 0.34464751958224543 2024 0.8642297650130548 2025 0.2950391644908616 2026 0.10704960835509138

Keywords

potential 1.0 target 0.9453665283540802 docking 0.1798063623789765 between 0.13001383125864455 novel 0.1206777316735823 analysis 0.1078838174273859 visualization 0.08990318118948824 energy 0.08782849239280774 binding 0.08437067773167359 activity 0.06604426002766252 well 0.051175656984785614 experimental 0.044605809128630707 chemical 0.03561549100968188 protein 0.03284923928077455 interaction 0.025933609958506226 drug 0.021092669432918397 synthesized 0.0169432918395574 development 0.01590594744121715 promising 0.014868603042876901 compound 0.012793914246196404 design 0.010027662517289074 catalyst 0.0031120331950207467 inhibition 0.0013831258644536654 treatment 6.915629322268327E-4 synthesis 0.0
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