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Application

Discovery Studio 1.0 Materials Studio 0.5829915560916767 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06287069988137604 Amorphous Cell 0.1534994068801898 Antibody 4.7449584816132857E-4 Blends 0.0033214709371293 CASTEP 0.3912218268090154 CDOCKER 0.37295373665480425 CHARMm 0.4647686832740214 COMPASS 0.26880189798339266 COMPASS III 0.03345195729537367 COSMObase 0.0011862396204033216 COSMOconf 2.3724792408066428E-4 COSMOperm 2.3724792408066428E-4 COSMOplex 0.0 COSMOquick 0.002135231316725979 COSMOtherm 0.052669039145907474 Catalyst 0.35966785290628706 Classical Simulations 1.0 Conformers 9.489916963226571E-4 Crystallization 0.07330960854092526 DFTB Plus 0.0033214709371293 DMol3 0.21803084223013047 DPD 0.005931198102016607 Discover 0.014709371293001186 Forcite 0.3539739027283511 GULP 0.0199288256227758 LUDI 0.026334519572953737 LibDock 0.1269276393831554 LigandFit 0.05029655990510083 MCSS 0.005219454329774615 MODELER 0.36298932384341637 MesoDyn 0.0033214709371293 Mesocite 0.005931198102016607 Mesoscale 0.012574139976275208 Morphology 0.012099644128113879 ONETEP 0.002372479240806643 Polymorph 0.0035587188612099642 QMERA 0.0 QSAR 0.002135231316725979 Quantum Mechanics 0.5997627520759193 Reflex 0.05741399762752076 Reflex Plus 0.0018979833926453143 Reflex QPA 0.0 Semi-empirical 0.005456702253855279 Sorption 0.025385527876631078 Synthia 7.117437722419929E-4 TURBOMOLE 4.7449584816132857E-4 VAMP 0.00166073546856465 Visualization 0.93570581257414 X-Cell 0.0030842230130486356 ZDOCK 0.03748517200474496

Year

1999 0.0 2000 0.0 2001 0.0 2002 0.00243605359317905 2003 0.00243605359317905 2004 0.0032480714575720666 2005 0.005278116118554608 2006 0.008120178643930167 2007 0.0097442143727162 2008 0.015022330491270807 2009 0.0194884287454324 2010 0.03654080389768575 2011 0.06008932196508323 2012 0.07105156313438896 2013 0.09703613479496549 2014 0.1027202598457166 2015 0.12017864393016646 2016 0.13357693869265125 2017 0.14129110840438489 2018 0.1847340641494113 2019 0.3032886723507917 2020 0.392204628501827 2021 0.46203816483962645 2022 0.5168493706861551 2023 0.7568006496142915 2024 1.0 2025 0.9216402760860739 2026 0.2298010556232237 2027 4.060089321965083E-4

Keywords

novel 1.0 target 0.9635098438560761 potential 0.2736761710794297 docking 0.2618805159538357 visualization 0.16564833672776647 synthesized 0.1354378818737271 analysis 0.13526816021724372 synthesis 0.10514256619144603 activity 0.1042090970807875 binding 0.08732179226069246 between 0.08579429735234216 compound 0.07942973523421588 design 0.07230142566191446 promising 0.06780380176510523 development 0.06687033265444671 protein 0.03173794976238968 drug 0.031653088934148 potent 0.02562797012898846 inhibition 0.022233536999321114 cell 0.02079090291921249 vitro 0.018245078071961983 effective 0.005685675492192804 energy 0.0036490156143923966 interaction 0.0011880515953835709 well 0.0
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