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Application

Discovery Studio 1.0 Materials Studio 0.8894348894348895 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05871313672922252 Amorphous Cell 0.27292225201072384 Blends 0.0018766756032171583 CASTEP 0.3112600536193029 CDOCKER 0.17828418230563003 CHARMm 0.2903485254691689 COMPASS 0.3284182305630027 COMPASS III 0.10187667560321716 COSMObase 0.004557640750670241 COSMOconf 0.006702412868632708 COSMOmic 0.0 COSMOperm 5.361930294906167E-4 COSMOplex 2.6809651474530834E-4 COSMOquick 8.042895442359249E-4 COSMOtherm 0.06353887399463808 Catalyst 0.08123324396782843 Classical Simulations 1.0 Conformers 2.6809651474530834E-4 Crystallization 0.06916890080428954 DFTB Plus 0.002412868632707775 DMol3 0.14101876675603217 DPD 0.0010723860589812334 Discover 0.004021447721179625 Forcite 0.5085790884718498 GULP 0.017962466487935657 Kinetix 0.0 LUDI 0.004557640750670241 LibDock 0.07640750670241286 LigandFit 0.004021447721179625 MCSS 5.361930294906167E-4 MODELER 0.27935656836461126 MesoDyn 5.361930294906167E-4 Mesocite 0.0029490616621983914 Mesoscale 0.004557640750670241 Morphology 0.015549597855227882 ONETEP 5.361930294906167E-4 Polymorph 0.0016085790884718498 QMERA 0.0 QSAR 5.361930294906167E-4 Quantum Mechanics 0.4431635388739946 Reflex 0.05120643431635389 Reflex Plus 0.0 Semi-empirical 0.004021447721179625 Sorption 0.05388739946380697 Synthia 8.042895442359249E-4 TURBOMOLE 0.0 VAMP 0.0010723860589812334 Visualization 0.739142091152815 X-Cell 0.0016085790884718498 ZDOCK 0.032975871313672925

Year

2024 0.34199497066219614 2025 1.0 2026 0.740989103101425 2027 0.0

Keywords

target 1.0 potential 0.324296411050865 docking 0.2412858249419055 analysis 0.2233410792667183 visualization 0.1755744900593855 between 0.14045959204750838 novel 0.09927704621740253 promising 0.08752904725019364 binding 0.087141750580945 energy 0.06312935708752905 cell 0.05641621482055254 activity 0.05318874257681384 stability 0.03963335915311128 performance 0.025819777949909632 including 0.025303382390911438 strong 0.016653756777691712 effective 0.015104570100697134 development 0.014975471210947586 mechanism 0.012006196746707979 protein 0.009295120061967466 synthesized 0.009036922282468371 interaction 0.007616834495223341 enhanced 0.0045184611412341855 experimental 0.0028401755744900596 therapeutic 0.0
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